Ligand source activities (1 row/activity)
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
CHEMBL1627325 | 215590 | 0 | None | -1 | 8 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(C)(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O | 10.1021/jm900604g | ||||
2098 | 10466 | 36 | None | -1 | 11 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm900604g | ||||
36511 | 10466 | 36 | None | -1 | 11 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm900604g | ||||
3805 | 10466 | 36 | None | -1 | 11 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm900604g | ||||
3835 | 10466 | 36 | None | -1 | 11 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm900604g | ||||
CHEMBL235363 | 10466 | 36 | None | -1 | 11 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm900604g | ||||
CHEMBL384518 | 219107 | 12 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(N)=O | 10.1021/jm000093v | ||||
2098 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm2017072 | ||||
36511 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm2017072 | ||||
3805 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm2017072 | ||||
3835 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm2017072 | ||||
CHEMBL235363 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm2017072 | ||||
2098 | 10466 | 36 | None | -1 | 11 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm000093v | ||||
36511 | 10466 | 36 | None | -1 | 11 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm000093v | ||||
3805 | 10466 | 36 | None | -1 | 11 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm000093v | ||||
3835 | 10466 | 36 | None | -1 | 11 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm000093v | ||||
CHEMBL235363 | 10466 | 36 | None | -1 | 11 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm000093v | ||||
2098 | 10466 | 36 | None | -2 | 11 | Guinea pig | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
36511 | 10466 | 36 | None | -2 | 11 | Guinea pig | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
3805 | 10466 | 36 | None | -2 | 11 | Guinea pig | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
3835 | 10466 | 36 | None | -2 | 11 | Guinea pig | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
CHEMBL235363 | 10466 | 36 | None | -2 | 11 | Guinea pig | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
73356363 | 96279 | 0 | None | 9 | 2 | Guinea pig | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 711 | 22 | 7 | 8 | 0.9 | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL2372949 | 96279 | 0 | None | 9 | 2 | Guinea pig | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 711 | 22 | 7 | 8 | 0.9 | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
44355648 | 103899 | 0 | None | -22 | 3 | Guinea pig | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 994 | 29 | 10 | 13 | -1.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL267712 | 103899 | 0 | None | -22 | 3 | Guinea pig | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 994 | 29 | 10 | 13 | -1.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
44355117 | 28560 | 0 | None | -19 | 3 | Guinea pig | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 946 | 28 | 10 | 13 | -2.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC2CCN(C(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL131923 | 28560 | 0 | None | -19 | 3 | Guinea pig | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 946 | 28 | 10 | 13 | -2.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC2CCN(C(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
44297675 | 107396 | 0 | None | -47 | 2 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 711 | 22 | 7 | 8 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL291903 | 107396 | 0 | None | -47 | 2 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 711 | 22 | 7 | 8 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
10259515 | 163916 | 0 | None | 954 | 2 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 751 | 22 | 6 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL407511 | 163916 | 0 | None | 954 | 2 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 751 | 22 | 6 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL263185 | 217340 | 5 | None | 2 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm000093v | ||||
2089 | 9542 | 28 | None | -6 | 8 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
3795 | 9542 | 28 | None | -6 | 8 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
5311311 | 9542 | 28 | None | -6 | 8 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
CHEMBL217406 | 9542 | 28 | None | -6 | 8 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
CHEMBL415159 | 219954 | 5 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1021/jm000093v | ||||
44297866 | 108821 | 0 | None | -38 | 2 | Guinea pig | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 723 | 21 | 6 | 8 | 1.0 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1CCC(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCN)C1=O)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL301841 | 108821 | 0 | None | -38 | 2 | Guinea pig | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 723 | 21 | 6 | 8 | 1.0 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1CCC(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCN)C1=O)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL441061 | 220658 | 19 | None | 2 | 2 | Guinea pig | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1021/jm00112a018 | ||||
73348740 | 96281 | 0 | None | 51 | 2 | Guinea pig | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 737 | 21 | 6 | 8 | 1.4 | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL2372953 | 96281 | 0 | None | 51 | 2 | Guinea pig | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 737 | 21 | 6 | 8 | 1.4 | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
44355678 | 30261 | 0 | None | 4 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 777 | 21 | 5 | 8 | 2.3 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@]2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL133362 | 30261 | 0 | None | 4 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 777 | 21 | 5 | 8 | 2.3 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@]2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
10350201 | 123939 | 0 | None | -6 | 2 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1C[C@@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL339391 | 123939 | 0 | None | -6 | 2 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1C[C@@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
10327810 | 123514 | 0 | None | -31 | 2 | Guinea pig | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1C[C@@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL337465 | 123514 | 0 | None | -31 | 2 | Guinea pig | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1C[C@@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
10055612 | 103200 | 0 | None | 31 | 3 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 711 | 23 | 7 | 8 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL262049 | 103200 | 0 | None | 31 | 3 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 711 | 23 | 7 | 8 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
14860666 | 112196 | 0 | None | -3 | 2 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 710 | 21 | 6 | 8 | 1.0 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)COC[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1021/jm00112a018 | ||
CHEMBL311917 | 112196 | 0 | None | -3 | 2 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 710 | 21 | 6 | 8 | 1.0 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)COC[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1021/jm00112a018 | ||
2098 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
36511 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
3805 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
3835 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
CHEMBL235363 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00169a003 | ||||
15931130 | 108758 | 0 | None | -1000 | 2 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 737 | 21 | 6 | 8 | 1.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL301477 | 108758 | 0 | None | -1000 | 2 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 737 | 21 | 6 | 8 | 1.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
5311135 | 28495 | 12 | None | -1148 | 3 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 920 | 29 | 11 | 13 | -2.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL131872 | 28495 | 12 | None | -1148 | 3 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 920 | 29 | 11 | 13 | -2.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
44355179 | 31120 | 0 | None | -33 | 2 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 962 | 30 | 11 | 13 | -2.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(C)=O)C(C)C)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL134091 | 31120 | 0 | None | -33 | 2 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 962 | 30 | 11 | 13 | -2.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(C)=O)C(C)C)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL134481 | 215508 | 0 | None | -1 | 3 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||||
2098 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
36511 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
3805 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
3835 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
CHEMBL235363 | 10466 | 36 | None | -2 | 11 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
10395375 | 123435 | 0 | None | -2 | 2 | Guinea pig | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1C[C@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL337037 | 123435 | 0 | None | -2 | 2 | Guinea pig | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1C[C@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
10462850 | 31035 | 0 | None | -36 | 2 | Guinea pig | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1C[C@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL134012 | 31035 | 0 | None | -36 | 2 | Guinea pig | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 763 | 21 | 5 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1C[C@H]2CCN(C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCCCN)[C@H]2C1=O)C(N)=O | 10.1021/jm00100a027 | ||
15931129 | 201757 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 22 | 7 | 8 | 0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL54622 | 201757 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 22 | 7 | 8 | 0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL81919 | 222665 | 0 | None | -676 | 2 | Guinea pig | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1021/jm00112a018 | ||||
CHEMBL335054 | 218259 | 0 | None | -20 | 3 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(N)=O | 10.1021/jm00100a027 | ||||
44297852 | 105783 | 0 | None | -7 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 763 | 20 | 5 | 8 | 1.9 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1CCC2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCN)C1=O)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL280020 | 105783 | 0 | None | -7 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 763 | 20 | 5 | 8 | 1.9 | CSCC[C@H](NC(=O)[C@@H](CC(C)C)N1CCC2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCN)C1=O)C(N)=O | 10.1021/jm00169a003 | ||
2090 | 9543 | 25 | None | -6 | 9 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
5311312 | 9543 | 25 | None | -6 | 9 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
CHEMBL437797 | 9543 | 25 | None | -6 | 9 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm00100a027 | ||||
11765601 | 103199 | 0 | None | -9 | 2 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 751 | 22 | 6 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL262048 | 103199 | 0 | None | -9 | 2 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 751 | 22 | 6 | 8 | 1.8 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(N)=O | 10.1021/jm00100a027 | ||
44355368 | 32413 | 0 | None | -1 | 3 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 737 | 22 | 6 | 8 | 1.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL135186 | 32413 | 0 | None | -1 | 3 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 737 | 22 | 6 | 8 | 1.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(N)=O | 10.1021/jm00100a027 | ||
10009596 | 122287 | 0 | None | 1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 663 | 22 | 7 | 8 | 0.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(C)C)C(N)=O | 10.1021/jm00100a027 | ||
CHEMBL335248 | 122287 | 0 | None | 1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 663 | 22 | 7 | 8 | 0.4 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCN)C(C)C)C(N)=O | 10.1021/jm00100a027 | ||
73356365 | 96282 | 0 | None | - | 1 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 752 | 21 | 8 | 7 | 1.5 | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/jm00169a003 | ||
CHEMBL2372954 | 96282 | 0 | None | - | 1 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 752 | 21 | 8 | 7 | 1.5 | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/jm00169a003 | ||
108167 | 9631 | 8 | None | 58 | 2 | Guinea pig | 10.7 | pIC50 | = | 10.7 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 10.1016/s0960-894x(98)00260-1 | ||
2107 | 9631 | 8 | None | 58 | 2 | Guinea pig | 10.7 | pIC50 | = | 10.7 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1178725 | 9631 | 8 | None | 58 | 2 | Guinea pig | 10.7 | pIC50 | = | 10.7 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 10.1016/s0960-894x(98)00260-1 | ||
135434109 | 11054 | 0 | None | - | 1 | Rat | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 446 | 6 | 2 | 5 | 5.3 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL100636 | 11054 | 0 | None | - | 1 | Rat | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 446 | 6 | 2 | 5 | 5.3 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
9967131 | 214284 | 1 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 326 | 6 | 2 | 4 | 3.3 | COc1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL94461 | 214284 | 1 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 326 | 6 | 2 | 4 | 3.3 | COc1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/s0960-894x(98)00012-2 | ||
10363809 | 118907 | 20 | None | - | 1 | Human | 10.0 | pIC50 | = | 10.0 | Functional | ChEMBL | 403 | 7 | 2 | 5 | 2.7 | COc1ccc(N(C)S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL329007 | 118907 | 20 | None | - | 1 | Human | 10.0 | pIC50 | = | 10.0 | Functional | ChEMBL | 403 | 7 | 2 | 5 | 2.7 | COc1ccc(N(C)S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
44328454 | 175517 | 0 | None | - | 1 | Human | 9.9 | pIC50 | = | 9.9 | Functional | ChEMBL | 330 | 5 | 2 | 3 | 3.9 | COc1ccc(Cl)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL437075 | 175517 | 0 | None | - | 1 | Human | 9.9 | pIC50 | = | 9.9 | Functional | ChEMBL | 330 | 5 | 2 | 3 | 3.9 | COc1ccc(Cl)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
10111225 | 214256 | 0 | None | - | 1 | Human | 9.9 | pIC50 | = | 9.9 | Functional | ChEMBL | 394 | 7 | 2 | 4 | 4.6 | CCOc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL94328 | 214256 | 0 | None | - | 1 | Human | 9.9 | pIC50 | = | 9.9 | Functional | ChEMBL | 394 | 7 | 2 | 4 | 4.6 | CCOc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
10477054 | 11265 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 417 | 4 | 1 | 2 | 6.3 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL102032 | 11265 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 417 | 4 | 1 | 2 | 6.3 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
10458573 | 11137 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 498 | 6 | 1 | 4 | 6.3 | C[C@@H](O[C@H]1CCCN(Cc2nc[nH]n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL101148 | 11137 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 498 | 6 | 1 | 4 | 6.3 | C[C@@H](O[C@H]1CCCN(Cc2nc[nH]n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
135488049 | 214994 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 514 | 6 | 2 | 5 | 6.0 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL98524 | 214994 | 0 | None | - | 1 | Rat | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 514 | 6 | 2 | 5 | 6.0 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
2102 | 7972 | 21 | None | 6 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1016285 | ||
5311057 | 7972 | 21 | None | 6 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1016285 | ||
CHEMBL441225 | 7972 | 21 | None | 6 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1016285 | ||
10480465 | 215194 | 0 | None | 1 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL99792 | 215194 | 0 | None | 1 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
10272852 | 114670 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 408 | 7 | 2 | 4 | 5.0 | CC(C)Oc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL319301 | 114670 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 408 | 7 | 2 | 4 | 5.0 | CC(C)Oc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
9821217 | 114507 | 21 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL319118 | 114507 | 21 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL3215877 | 114507 | 21 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
9871754 | 12181 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
CHEMBL107172 | 12181 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
2098 | 10466 | 36 | None | -1 | 11 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)10097-X | ||||
36511 | 10466 | 36 | None | -1 | 11 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)10097-X | ||||
3805 | 10466 | 36 | None | -1 | 11 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)10097-X | ||||
3835 | 10466 | 36 | None | -1 | 11 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)10097-X | ||||
CHEMBL235363 | 10466 | 36 | None | -1 | 11 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)10097-X | ||||
44433394 | 153436 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.09.053 | ||
CHEMBL392368 | 153436 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.09.053 | ||
44433394 | 153436 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1013693 | ||
CHEMBL392368 | 153436 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1013693 | ||
9960689 | 18777 | 1 | None | - | 1 | Guinea pig | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]34CCC(c5ccccc5)(CC3)CC4)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1183286 | 18777 | 1 | None | - | 1 | Guinea pig | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]34CCC(c5ccccc5)(CC3)CC4)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL288600 | 18777 | 1 | None | - | 1 | Guinea pig | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 619 | 9 | 0 | 2 | 8.2 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]34CCC(c5ccccc5)(CC3)CC4)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
9871754 | 12181 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
CHEMBL107172 | 12181 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
9945487 | 214530 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 332 | 6 | 2 | 3 | 3.9 | FC(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL95852 | 214530 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 332 | 6 | 2 | 3 | 3.9 | FC(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
10268178 | 214438 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 324 | 6 | 2 | 3 | 4.1 | CC(C)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL95315 | 214438 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 324 | 6 | 2 | 3 | 4.1 | CC(C)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
2102 | 7972 | 21 | None | 6 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
5311057 | 7972 | 21 | None | 6 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL441225 | 7972 | 21 | None | 6 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
104943 | 62160 | 39 | None | 4 | 4 | Guinea pig | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL16192 | 62160 | 39 | None | 4 | 4 | Guinea pig | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10097-X | ||
22879211 | 214922 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 339 | 6 | 2 | 4 | 3.3 | COc1ccc(N(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL98125 | 214922 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 339 | 6 | 2 | 4 | 3.3 | COc1ccc(N(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
44433393 | 174426 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 352 | 5 | 2 | 3 | 4.6 | COc1ccc(C(C)(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.09.053 | ||
CHEMBL430170 | 174426 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 352 | 5 | 2 | 3 | 4.6 | COc1ccc(C(C)(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.09.053 | ||
44433393 | 174426 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 352 | 5 | 2 | 3 | 4.6 | COc1ccc(C(C)(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1013693 | ||
CHEMBL430170 | 174426 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 352 | 5 | 2 | 3 | 4.6 | COc1ccc(C(C)(C)C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm1013693 | ||
2098 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00012-2 | ||||
36511 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00012-2 | ||||
3805 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00012-2 | ||||
3835 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00012-2 | ||||
CHEMBL235363 | 10466 | 36 | None | -1 | 11 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00012-2 | ||||
132846 | 104223 | 23 | None | 1 | 4 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL1256740 | 104223 | 23 | None | 1 | 4 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL27006 | 104223 | 23 | None | 1 | 4 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
9968267 | 115333 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 350 | 5 | 2 | 3 | 4.2 | FC(F)(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL320220 | 115333 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 350 | 5 | 2 | 3 | 4.2 | FC(F)(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
10089212 | 11278 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 349 | 4 | 1 | 2 | 5.6 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL102157 | 11278 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 349 | 4 | 1 | 2 | 5.6 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
10047566 | 172020 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm00008a003 | ||
CHEMBL422931 | 172020 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm00008a003 | ||
10650495 | 114196 | 0 | None | - | 1 | Guinea pig | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C#N | 10.1021/jm970499g | ||
CHEMBL318085 | 114196 | 0 | None | - | 1 | Guinea pig | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C#N | 10.1021/jm970499g | ||
11801327 | 16128 | 0 | None | - | 1 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 578 | 10 | 2 | 4 | 5.4 | COCc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
CHEMBL111295 | 16128 | 0 | None | - | 1 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 578 | 10 | 2 | 4 | 5.4 | COCc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
9871754 | 12181 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
CHEMBL107172 | 12181 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1016/j.bmc.2008.09.037 | ||
135413536 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
230 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
3490 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
6918365 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
CHEMBL1471 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
DB00673 | 7236 | 85 | None | 3 | 3 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00793 | ||
9832207 | 18771 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1183274 | 18771 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL288123 | 18771 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
10817013 | 16028 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(N)=O | 10.1021/jm970499g | ||
CHEMBL110770 | 16028 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(N)=O | 10.1021/jm970499g | ||
44327794 | 118199 | 2 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 366 | 5 | 3 | 4 | 3.9 | Oc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL327357 | 118199 | 2 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 366 | 5 | 3 | 4 | 3.9 | Oc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(98)00012-2 | ||
CHEMBL2369600 | 216413 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm990461z | ||||
44286165 | 165174 | 0 | None | - | 1 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 646 | 8 | 0 | 4 | 8.3 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3C4CCC3CC3(C4)OCc4ccccc43)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1794935 | 165174 | 0 | None | - | 1 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 646 | 8 | 0 | 4 | 8.3 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3C4CCC3CC3(C4)OCc4ccccc43)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL40900 | 165174 | 0 | None | - | 1 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 646 | 8 | 0 | 4 | 8.3 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3C4CCC3CC3(C4)OCc4ccccc43)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL5074991 | 221128 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | None | None | None | C[C@@H](O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OCc1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00793 | ||||
10039383 | 92252 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm00008a003 | ||
CHEMBL22680 | 92252 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm00008a003 | ||
15542673 | 214343 | 0 | None | 1 | 2 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL94834 | 214343 | 0 | None | 1 | 2 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
44327909 | 119135 | 0 | None | 37 | 2 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 706 | 14 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL329450 | 119135 | 0 | None | 37 | 2 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 706 | 14 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL2304126 | 216259 | 0 | None | - | 1 | Rat | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | None | None | None | COC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1 | 10.1021/jm00157a009 | ||||
9832306 | 119501 | 0 | None | -2 | 2 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330367 | 119501 | 0 | None | -2 | 2 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330462 | 119501 | 0 | None | -2 | 2 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
10123138 | 115303 | 0 | None | 1 | 2 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL317524 | 115303 | 0 | None | 1 | 2 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL320002 | 115303 | 0 | None | 1 | 2 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10190842 | 114001 | 0 | None | 63 | 2 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 788 | 16 | 0 | 11 | 7.1 | COC(=O)c1ccccc1OCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL316705 | 114001 | 0 | None | 63 | 2 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 788 | 16 | 0 | 11 | 7.1 | COC(=O)c1ccccc1OCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
44286051 | 18778 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 724 | 10 | 1 | 3 | 9.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(Cc4ccccc4)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1183288 | 18778 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 724 | 10 | 1 | 3 | 9.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(Cc4ccccc4)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL288840 | 18778 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 724 | 10 | 1 | 3 | 9.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(Cc4ccccc4)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
44285793 | 107066 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 620 | 8 | 0 | 4 | 7.8 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)OCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1201933 | 107066 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 620 | 8 | 0 | 4 | 7.8 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)OCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL289091 | 107066 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 620 | 8 | 0 | 4 | 7.8 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)OCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
44331794 | 10971 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 267 | 4 | 1 | 2 | 3.7 | c1ccc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL100178 | 10971 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 267 | 4 | 1 | 2 | 3.7 | c1ccc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL2369697 | 216429 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm990461z | ||||
10769060 | 12806 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1 | 10.1021/jm970499g | ||
CHEMBL108040 | 12806 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1 | 10.1021/jm970499g | ||
44285794 | 148579 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 652 | 8 | 0 | 4 | 7.5 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)c3ccccc3C[S+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL38624 | 148579 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 652 | 8 | 0 | 4 | 7.5 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)c3ccccc3C[S+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
44213067 | 18783 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 648 | 8 | 1 | 3 | 7.6 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1183307 | 18783 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 648 | 8 | 1 | 3 | 7.6 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL289727 | 18783 | 0 | None | - | 1 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 648 | 8 | 1 | 3 | 7.6 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
10626666 | 115972 | 0 | None | - | 1 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(C#N)cc1 | 10.1021/jm970499g | ||
CHEMBL321554 | 115972 | 0 | None | - | 1 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(C#N)cc1 | 10.1021/jm970499g | ||
10602943 | 114195 | 0 | None | - | 1 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C#N)c1 | 10.1021/jm970499g | ||
CHEMBL318084 | 114195 | 0 | None | - | 1 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C#N)c1 | 10.1021/jm970499g | ||
10168749 | 214400 | 0 | None | 3 | 2 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL95127 | 214400 | 0 | None | 3 | 2 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10745241 | 117308 | 0 | None | -1 | 2 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 549 | 8 | 3 | 4 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1N | 10.1021/jm970499g | ||
CHEMBL325116 | 117308 | 0 | None | -1 | 2 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 549 | 8 | 3 | 4 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1N | 10.1021/jm970499g | ||
CHEMBL2369696 | 216428 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm990461z | ||||
10234086 | 118411 | 0 | None | 6 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL328511 | 118411 | 0 | None | 6 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10097-X | ||
10258866 | 23374 | 6 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 664 | 5 | 4 | 6 | 3.1 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1CC1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)c3ccccc3N[C@H]21 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL124066 | 23374 | 6 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 664 | 5 | 4 | 6 | 3.1 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1CC1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)c3ccccc3N[C@H]21 | 10.1016/0960-894X(95)00039-V | ||
136035319 | 170077 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 446 | 6 | 2 | 5 | 5.3 | C[C@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL418800 | 170077 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 446 | 6 | 2 | 5 | 5.3 | C[C@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
10027061 | 21724 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | ||
CHEMBL120844 | 21724 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | ||
CHEMBL2304029 | 216255 | 0 | None | - | 1 | Rat | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | None | None | None | COC(=O)[C@@H](CCSC)NC(=O)[C@@H](CC(C)C)SCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1 | 10.1021/jm00157a009 | ||||
10122529 | 116333 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL322194 | 116333 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
44349304 | 23750 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 468 | 5 | 3 | 5 | 2.9 | COc1ccc(N)cc1C[C@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL125385 | 23750 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 468 | 5 | 3 | 5 | 2.9 | COc1ccc(N)cc1C[C@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
10212645 | 20061 | 0 | None | 346 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL1191766 | 20061 | 0 | None | 346 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL542908 | 20061 | 0 | None | 346 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
15542881 | 119368 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330172 | 119368 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10233656 | 214630 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL96442 | 214630 | 0 | None | 3 | 2 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10283825 | 103468 | 0 | None | 1 | 2 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL264007 | 103468 | 0 | None | 1 | 2 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
153996 | 119445 | 2 | None | 1 | 6 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330366 | 119445 | 2 | None | 1 | 6 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL539021 | 119445 | 2 | None | 1 | 6 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10507650 | 170109 | 0 | None | - | 1 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 591 | 9 | 3 | 4 | 4.6 | CNC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
CHEMBL419004 | 170109 | 0 | None | - | 1 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 591 | 9 | 3 | 4 | 4.6 | CNC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
14986134 | 170612 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2017.06.056 | ||
CHEMBL4206396 | 170612 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2017.06.056 | ||
9918576 | 214116 | 0 | None | 2 | 3 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL93556 | 214116 | 0 | None | 2 | 3 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
44286200 | 148631 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 633 | 8 | 1 | 4 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL38652 | 148631 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 633 | 8 | 1 | 4 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)NCCc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
10147107 | 214399 | 0 | None | 3 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL431850 | 214399 | 0 | None | 3 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL95125 | 214399 | 0 | None | 3 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL2304032 | 216256 | 0 | None | - | 1 | Rat | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | None | None | None | COC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)SCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1 | 10.1021/jm00157a009 | ||||
10212223 | 214919 | 0 | None | 2 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL431458 | 214919 | 0 | None | 2 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL98079 | 214919 | 0 | None | 2 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
9832207 | 18771 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1183274 | 18771 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL288123 | 18771 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 662 | 8 | 1 | 3 | 7.1 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL5083565 | 221650 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | None | None | None | C[C@@H](O[C@H]1O[C@@H]2CC[C@@H](c3ccccc3)O[C@@H]2[C@H](O)[C@H]1OCc1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00793 | ||||
10121390 | 119516 | 0 | None | 3 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330499 | 119516 | 0 | None | 3 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
10123040 | 167874 | 0 | None | 7 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL411691 | 167874 | 0 | None | 7 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL537027 | 167874 | 0 | None | 7 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
15542879 | 119601 | 0 | None | 2 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330719 | 119601 | 0 | None | 2 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
44349364 | 123609 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 468 | 5 | 3 | 5 | 2.9 | COc1ccc(N)cc1C[C@@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL337987 | 123609 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 468 | 5 | 3 | 5 | 2.9 | COc1ccc(N)cc1C[C@@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
10578261 | 15955 | 0 | None | - | 1 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 535 | 8 | 2 | 4 | 4.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccnc1 | 10.1021/jm970499g | ||
CHEMBL110301 | 15955 | 0 | None | - | 1 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 535 | 8 | 2 | 4 | 4.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccnc1 | 10.1021/jm970499g | ||
10360490 | 95514 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 349 | 5 | 1 | 2 | 4.8 | Clc1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
CHEMBL23617 | 95514 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 349 | 5 | 1 | 2 | 4.8 | Clc1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
44286038 | 17982 | 0 | None | - | 1 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 662 | 9 | 1 | 3 | 7.9 | CC[N+]1(CCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)Cc3cccc(OC(C)C)c3)C2)CCC2(CC1)NCCc1ccccc12 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1178749 | 17982 | 0 | None | - | 1 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 662 | 9 | 1 | 3 | 7.9 | CC[N+]1(CCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)Cc3cccc(OC(C)C)c3)C2)CCC2(CC1)NCCc1ccccc12 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL39595 | 17982 | 0 | None | - | 1 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 662 | 9 | 1 | 3 | 7.9 | CC[N+]1(CCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)Cc3cccc(OC(C)C)c3)C2)CCC2(CC1)NCCc1ccccc12 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL2304118 | 216258 | 0 | None | - | 1 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)O | 10.1021/jm00157a009 | ||||
10190413 | 214108 | 0 | None | 3 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL410270 | 214108 | 0 | None | 3 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL93519 | 214108 | 0 | None | 3 | 2 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
10417124 | 125258 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 678 | 5 | 4 | 6 | 3.4 | Cc1cccc2c1C1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1N2 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL341365 | 125258 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 678 | 5 | 4 | 6 | 3.4 | Cc1cccc2c1C1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1N2 | 10.1016/0960-894X(95)00039-V | ||
44349370 | 124050 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 484 | 5 | 3 | 6 | 2.9 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@]1(Cc3cc([N+](=O)[O-])ccc3O)c3ccccc3N[C@H]21 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL339488 | 124050 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 484 | 5 | 3 | 6 | 2.9 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@]1(Cc3cc([N+](=O)[O-])ccc3O)c3ccccc3N[C@H]21 | 10.1016/0960-894X(95)00039-V | ||
15542871 | 214634 | 0 | None | 1 | 2 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 726 | 9 | 0 | 7 | 8.0 | O=C(c1nc2ccccc2n1Cc1ccc(F)cc1)C1CCN(CCC2(c3ccc4c(c3)OCO4)CCN(C(=O)c3ccc(Cl)cc3Cl)C2)CC1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL96466 | 214634 | 0 | None | 1 | 2 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 726 | 9 | 0 | 7 | 8.0 | O=C(c1nc2ccccc2n1Cc1ccc(F)cc1)C1CCN(CCC2(c3ccc4c(c3)OCO4)CCN(C(=O)c3ccc(Cl)cc3Cl)C2)CC1 | 10.1016/S0960-894X(97)10098-1 | ||
10530375 | 12401 | 0 | None | - | 1 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 534 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 | 10.1021/jm970499g | ||
CHEMBL107763 | 12401 | 0 | None | - | 1 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 534 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 | 10.1021/jm970499g | ||
10917690 | 214384 | 1 | None | 3 | 4 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95051 | 214384 | 1 | None | 3 | 4 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
44328187 | 214918 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 456 | 7 | 0 | 5 | 5.6 | COc1ccc(CCN2CCC(=Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL98076 | 214918 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 456 | 7 | 0 | 5 | 5.6 | COc1ccc(CCN2CCC(=Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
135556923 | 114177 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 378 | 6 | 2 | 5 | 4.0 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL317979 | 114177 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 378 | 6 | 2 | 5 | 4.0 | C[C@@H](O[C@H]1CCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10118-4 | ||
9832306 | 119501 | 0 | None | -2 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330367 | 119501 | 0 | None | -2 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330462 | 119501 | 0 | None | -2 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL2304130 | 216261 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1)C(=O)O | 10.1021/jm00157a009 | ||||
10917690 | 214384 | 1 | None | -999 | 4 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL95051 | 214384 | 1 | None | -999 | 4 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
44285795 | 103275 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 647 | 8 | 1 | 4 | 6.9 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL262540 | 103275 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 647 | 8 | 1 | 4 | 6.9 | CC(C)Oc1cccc(CC(=O)N2CCCC(CCN3CCC4(CC3)NC(=O)Cc3ccccc34)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
44349303 | 123997 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 498 | 6 | 2 | 6 | 3.2 | COc1ccc([N+](=O)[O-])cc1C[C@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL339444 | 123997 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 498 | 6 | 2 | 6 | 3.2 | COc1ccc([N+](=O)[O-])cc1C[C@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL2304129 | 216260 | 0 | None | - | 1 | Rat | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | None | None | None | COC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1 | 10.1021/jm00157a009 | ||||
10620143 | 106038 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
CHEMBL281828 | 106038 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
10327313 | 23649 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 692 | 5 | 4 | 6 | 3.7 | Cc1cccc2c1C1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3cccc(C)c34)C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1N2 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL124979 | 23649 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 692 | 5 | 4 | 6 | 3.7 | Cc1cccc2c1C1(C34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3cccc(C)c34)C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@H]1N2 | 10.1016/0960-894X(95)00039-V | ||
15831290 | 153384 | 0 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 535 | 7 | 1 | 3 | 6.4 | CN(CC(CCN1CCC2(CC1)NCCc1ccccc12)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL39232 | 153384 | 0 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 535 | 7 | 1 | 3 | 6.4 | CN(CC(CCN1CCC2(CC1)NCCc1ccccc12)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1016/s0960-894x(98)00260-1 | ||
10603544 | 117341 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 592 | 9 | 2 | 5 | 5.0 | COC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
CHEMBL325312 | 117341 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 592 | 9 | 2 | 5 | 5.0 | COC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
10190056 | 118215 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL327497 | 118215 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
44285857 | 17970 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 667 | 8 | 0 | 3 | 7.7 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)c3ccccc3C[S+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL1178703 | 17970 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 667 | 8 | 0 | 3 | 7.7 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)c3ccccc3C[S+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL38030 | 17970 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 667 | 8 | 0 | 3 | 7.7 | CC(C)Oc1cccc(CC(=O)N2CCCC(CC[N+]3(C)CCC4(CC3)c3ccccc3C[S+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(98)00260-1 | ||
10190638 | 214321 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL94726 | 214321 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10283825 | 103468 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL264007 | 103468 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10283765 | 114864 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 730 | 12 | 0 | 8 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL319535 | 114864 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 730 | 12 | 0 | 8 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c1 | 10.1016/S0960-894X(97)10098-1 | ||
15542874 | 118946 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 786 | 12 | 0 | 8 | 8.7 | COc1cc(C(=O)N2CCCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL329055 | 118946 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 786 | 12 | 0 | 8 | 8.7 | COc1cc(C(=O)N2CCCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10769059 | 115394 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(F)c1 | 10.1021/jm970499g | ||
CHEMBL320581 | 115394 | 0 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(F)c1 | 10.1021/jm970499g | ||
10123138 | 115303 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL317524 | 115303 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL320002 | 115303 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
15542673 | 214343 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL94834 | 214343 | 0 | None | 1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
18333379 | 214354 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 686 | 15 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(F)cc4)CCN(Cc4cc(OC)c(OC)c(OC)c4)C3=O)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL94906 | 214354 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 686 | 15 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(F)cc4)CCN(Cc4cc(OC)c(OC)c(OC)c4)C3=O)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
10305069 | 214629 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 656 | 12 | 1 | 9 | 5.4 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL96441 | 214629 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 656 | 12 | 1 | 9 | 5.4 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL2304115 | 216257 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | None | None | None | COC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1 | 10.1021/jm00157a009 | ||||
10190056 | 118215 | 0 | None | -1 | 2 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL327497 | 118215 | 0 | None | -1 | 2 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
10212725 | 104945 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 790 | 15 | 1 | 11 | 6.6 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL273915 | 104945 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 790 | 15 | 1 | 11 | 6.6 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
15542679 | 115304 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 664 | 10 | 1 | 7 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL320003 | 115304 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 664 | 10 | 1 | 7 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
9918576 | 214116 | 0 | None | 2 | 3 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL93556 | 214116 | 0 | None | 2 | 3 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
10190413 | 214108 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL410270 | 214108 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL93519 | 214108 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
44328188 | 118303 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 728 | 16 | 0 | 11 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(OC)c(OC)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL327888 | 118303 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 728 | 16 | 0 | 11 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(OC)c(OC)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
15542879 | 119601 | 0 | None | 2 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330719 | 119601 | 0 | None | 2 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10121390 | 119516 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330499 | 119516 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10123040 | 167874 | 0 | None | 7 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL411691 | 167874 | 0 | None | 7 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL537027 | 167874 | 0 | None | 7 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10190770 | 214794 | 0 | None | 1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330430 | 214794 | 0 | None | 1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL97357 | 214794 | 0 | None | 1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10212223 | 214919 | 0 | None | 2 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL431458 | 214919 | 0 | None | 2 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL98079 | 214919 | 0 | None | 2 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10147107 | 214399 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL431850 | 214399 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95125 | 214399 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
18333241 | 214572 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 736 | 14 | 0 | 9 | 7.2 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL96141 | 214572 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 736 | 14 | 0 | 9 | 7.2 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
10233656 | 214630 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL96442 | 214630 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10147218 | 114243 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 778 | 15 | 0 | 10 | 7.5 | CCOC(=O)CCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL318369 | 114243 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 778 | 15 | 0 | 10 | 7.5 | CCOC(=O)CCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
15542881 | 119368 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL330172 | 119368 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
44328321 | 174567 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 788 | 17 | 1 | 10 | 7.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL430471 | 174567 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 788 | 17 | 1 | 10 | 7.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10122529 | 116333 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL322194 | 116333 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
10169609 | 214424 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 804 | 15 | 0 | 12 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccc(OC)c(OC)c5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95243 | 214424 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 804 | 15 | 0 | 12 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccc(OC)c(OC)c5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
10234086 | 118411 | 0 | None | 6 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL328511 | 118411 | 0 | None | 6 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
15542880 | 214285 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 705 | 12 | 0 | 9 | 6.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL94480 | 214285 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 705 | 12 | 0 | 9 | 6.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10168749 | 214400 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95127 | 214400 | 0 | None | 3 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
10305888 | 214334 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 750 | 14 | 1 | 9 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCC(=O)O)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL94788 | 214334 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 750 | 14 | 1 | 9 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCC(=O)O)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
44328320 | 214380 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 802 | 17 | 0 | 11 | 7.5 | COC(=O)c1ccccc1OCCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95029 | 214380 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 802 | 17 | 0 | 11 | 7.5 | COC(=O)c1ccccc1OCCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
10284042 | 214765 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 777 | 13 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCN4CCOCC4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL97240 | 214765 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 777 | 13 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCN4CCOCC4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
15542869 | 214388 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 720 | 15 | 0 | 10 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOCc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
CHEMBL95076 | 214388 | 0 | None | -1 | 2 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 720 | 15 | 0 | 10 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOCc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
9892984 | 151043 | 1 | None | - | 1 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 522 | 7 | 0 | 3 | 6.8 | CN(CC(CCN1CCC2(CC1)OCc1ccccc12)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1016/s0960-894x(98)00260-1 | ||
CHEMBL39049 | 151043 | 1 | None | - | 1 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 522 | 7 | 0 | 3 | 6.8 | CN(CC(CCN1CCC2(CC1)OCc1ccccc12)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1016/s0960-894x(98)00260-1 | ||
11801586 | 12238 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 591 | 9 | 3 | 4 | 5.2 | CC(=O)Nc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
CHEMBL107502 | 12238 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 591 | 9 | 3 | 4 | 5.2 | CC(=O)Nc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | ||
14986135 | 170180 | 0 | None | -10 | 3 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2017.06.056 | ||
CHEMBL419500 | 170180 | 0 | None | -10 | 3 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2017.06.056 | ||
CHEMBL5078626 | 221351 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | None | None | None | C[C@@H](O[C@H]1OC[C@H](O)[C@H](O)[C@H]1OCc1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00793 | ||||
44331786 | 114594 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 349 | 4 | 1 | 2 | 5.6 | C[C@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL319212 | 114594 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 349 | 4 | 1 | 2 | 5.6 | C[C@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(97)10118-4 | ||
44331715 | 11506 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 281 | 4 | 1 | 2 | 4.3 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL103657 | 11506 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 281 | 4 | 1 | 2 | 4.3 | C[C@@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)10118-4 | ||
44331792 | 113960 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 417 | 4 | 1 | 2 | 6.3 | C[C@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
CHEMBL316486 | 113960 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 417 | 4 | 1 | 2 | 6.3 | C[C@H](O[C@H]1CCCN[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)10118-4 | ||
44349375 | 121836 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 498 | 6 | 2 | 6 | 3.2 | COc1ccc([N+](=O)[O-])cc1C[C@@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL334304 | 121836 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 498 | 6 | 2 | 6 | 3.2 | COc1ccc([N+](=O)[O-])cc1C[C@@]12C[C@H]3C(=O)N[C@@H](Cc4ccccc4)C(=O)N3[C@@H]1Nc1ccccc12 | 10.1016/0960-894X(95)00039-V | ||
10063954 | 105508 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
CHEMBL277918 | 105508 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm00008a003 | ||
10190770 | 214794 | 0 | None | 1 | 2 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL330430 | 214794 | 0 | None | 1 | 2 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
CHEMBL97357 | 214794 | 0 | None | 1 | 2 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
44349369 | 23671 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4.0 | Functional | ChEMBL | 484 | 5 | 3 | 6 | 2.9 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@@]1(Cc3cc([N+](=O)[O-])ccc3O)c3ccccc3N[C@@H]21 | 10.1016/0960-894X(95)00039-V | ||
CHEMBL125093 | 23671 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4.0 | Functional | ChEMBL | 484 | 5 | 3 | 6 | 2.9 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@@]1(Cc3cc([N+](=O)[O-])ccc3O)c3ccccc3N[C@@H]21 | 10.1016/0960-894X(95)00039-V | ||
44407908 | 147335 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 687 | 9 | 1 | 7 | 4.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCS(=O)(=O)CC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381155 | 147335 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 687 | 9 | 1 | 7 | 4.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCS(=O)(=O)CC1 | 10.1016/j.bmcl.2005.10.077 | ||
44408039 | 82277 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 569 | 8 | 2 | 5 | 4.9 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204297 | 82277 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 569 | 8 | 2 | 5 | 4.9 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN | 10.1016/j.bmcl.2005.10.077 | ||
44408088 | 146603 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 639 | 9 | 1 | 6 | 5.3 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL379898 | 146603 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 639 | 9 | 1 | 6 | 5.3 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
44408089 | 146964 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL380449 | 146964 | 0 | None | - | 0 | Human | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
44408045 | 82381 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 583 | 9 | 2 | 5 | 5.2 | CNCCO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204691 | 82381 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 583 | 9 | 2 | 5 | 5.2 | CNCCO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
104943 | 62160 | 39 | None | -4 | 4 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | ||
CHEMBL16192 | 62160 | 39 | None | -4 | 4 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | ||
3086681 | 9052 | 17 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | ||
3510 | 9052 | 17 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | ||
CHEMBL42407 | 9052 | 17 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | ||
44370529 | 55833 | 0 | None | - | 0 | Guinea pig | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 643 | 10 | 3 | 7 | 3.0 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)N1C(C(=O)N(C)Cc2ccccc2)CC2CCCCC21)C(C)O | 10.1021/jm960213s | ||
CHEMBL156128 | 55833 | 0 | None | - | 0 | Guinea pig | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 643 | 10 | 3 | 7 | 3.0 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)N1C(C(=O)N(C)Cc2ccccc2)CC2CCCCC21)C(C)O | 10.1021/jm960213s | ||
44408040 | 81194 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 637 | 7 | 1 | 6 | 5.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC2=NOC(CN3CCOCC3)C2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL202627 | 81194 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 637 | 7 | 1 | 6 | 5.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC2=NOC(CN3CCOCC3)C2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
44407998 | 82273 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204262 | 82273 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
44407971 | 147532 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 625 | 9 | 1 | 6 | 4.9 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381822 | 147532 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 625 | 9 | 1 | 6 | 4.9 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
44370713 | 57806 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 653 | 13 | 4 | 7 | 3.2 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)NC(Cc1ccccc1)C(=O)N(C)C(C)c1ccccc1)C(C)O | 10.1021/jm960213s | ||
CHEMBL157858 | 57806 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 653 | 13 | 4 | 7 | 3.2 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)NC(Cc1ccccc1)C(=O)N(C)C(C)c1ccccc1)C(C)O | 10.1021/jm960213s | ||
44305816 | 169798 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 589 | 8 | 2 | 4 | 3.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)C1C=[N+](C)c2ccccc21 | 10.1016/S0960-894X(96)00604-X | ||
CHEMBL417572 | 169798 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 589 | 8 | 2 | 4 | 3.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)C1C=[N+](C)c2ccccc21 | 10.1016/S0960-894X(96)00604-X | ||
44408051 | 148005 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 635 | 7 | 1 | 6 | 5.6 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2cc(CN3CCOCC3)on2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL382871 | 148005 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 635 | 7 | 1 | 6 | 5.6 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2cc(CN3CCOCC3)on2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
21041073 | 145627 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL378156 | 145627 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
9829083 | 126917 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | ||
CHEMBL351274 | 126917 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | ||
2102 | 7972 | 21 | None | 6 | 2 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(96)00604-X | ||
5311057 | 7972 | 21 | None | 6 | 2 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(96)00604-X | ||
CHEMBL441225 | 7972 | 21 | None | 6 | 2 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(96)00604-X | ||
44407906 | 81483 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL203064 | 81483 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
9874480 | 81548 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 661 | 9 | 3 | 4 | 6.1 | COc1ccccc1CNCCNC(=O)N1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL203113 | 81548 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 661 | 9 | 3 | 4 | 6.1 | COc1ccccc1CNCCNC(=O)N1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
44407907 | 82472 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204764 | 82472 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
44408025 | 82690 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204979 | 82690 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
44407917 | 103333 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 617 | 8 | 1 | 5 | 6.6 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCc1ccccn1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL262989 | 103333 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 617 | 8 | 1 | 5 | 6.6 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCc1ccccn1 | 10.1016/j.bmcl.2005.10.077 | ||
44407903 | 147500 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 655 | 9 | 1 | 6 | 6.0 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCSCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381778 | 147500 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 655 | 9 | 1 | 6 | 6.0 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCSCC1 | 10.1016/j.bmcl.2005.10.077 | ||
44407902 | 82199 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 652 | 9 | 1 | 6 | 5.2 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCN(C)CC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL204114 | 82199 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 652 | 9 | 1 | 6 | 5.2 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCN(C)CC1 | 10.1016/j.bmcl.2005.10.077 | ||
44408046 | 147522 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381814 | 147522 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
104943 | 62160 | 39 | None | -4 | 4 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | ||
CHEMBL16192 | 62160 | 39 | None | -4 | 4 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | ||
44407972 | 147534 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 653 | 9 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381825 | 147534 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 653 | 9 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
44370530 | 55897 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 639 | 13 | 4 | 7 | 2.6 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)NC(Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm960213s | ||
CHEMBL156186 | 55897 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 639 | 13 | 4 | 7 | 2.6 | CC(=O)NC(C(=O)N[C@H](Cc1cc2ccccc2n1C(C)=O)C(=O)NC(Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm960213s | ||
44307819 | 109373 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL304106 | 109373 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
44307677 | 176043 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL441252 | 176043 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
44307678 | 205454 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL57993 | 205454 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | ||
44307757 | 210315 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL66441 | 210315 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
9874206 | 210550 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL68060 | 210550 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
57394644 | 75140 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 721 | 10 | 4 | 6 | 4.3 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | ||
CHEMBL1916633 | 75140 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 721 | 10 | 4 | 6 | 4.3 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | ||
10032981 | 113529 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 746 | 12 | 3 | 8 | 3.3 | COC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
CHEMBL3144347 | 113529 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 746 | 12 | 3 | 8 | 3.3 | COC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
10055415 | 113533 | 0 | None | -2 | 4 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144352 | 113533 | 0 | None | -2 | 4 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
118718516 | 122139 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7 | Functional | ChEMBL | 1599 | 27 | 12 | 16 | 2.8 | CC(C)C[C@H]1C(=O)N[C@@H](CCSCCSCC[C@@H]2NC(=O)[C@H](CC(C)C)N3C=C[C@@H](NC(=O)[C@H](Cc4ccccc4)N(C)C(=O)[C@@H](Cc4c[nH]c5ccccc45)NC(=O)[C@H](CCC(N)=O)NC2=O)C3=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H]2C=CN1C2=O | 10.1021/jm00053a001 | ||
CHEMBL3349687 | 122139 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7 | Functional | ChEMBL | 1599 | 27 | 12 | 16 | 2.8 | CC(C)C[C@H]1C(=O)N[C@@H](CCSCCSCC[C@@H]2NC(=O)[C@H](CC(C)C)N3C=C[C@@H](NC(=O)[C@H](Cc4ccccc4)N(C)C(=O)[C@@H](Cc4c[nH]c5ccccc45)NC(=O)[C@H](CCC(N)=O)NC2=O)C3=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H]2C=CN1C2=O | 10.1021/jm00053a001 | ||
9939040 | 11782 | 7 | None | - | 2 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | ||
CHEMBL105060 | 11782 | 7 | None | - | 2 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | ||
44307679 | 210296 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL66332 | 210296 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | ||
44307820 | 210414 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL67171 | 210414 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
57391132 | 75141 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 599 | 10 | 3 | 6 | 2.6 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | ||
CHEMBL1916634 | 75141 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 599 | 10 | 3 | 6 | 2.6 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | ||
10395494 | 113531 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 788 | 12 | 3 | 8 | 4.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144349 | 113531 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 788 | 12 | 3 | 8 | 4.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
9832198 | 113532 | 0 | None | 1 | 4 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144351 | 113532 | 0 | None | 1 | 4 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
44384380 | 66598 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 933 | 21 | 8 | 8 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL172794 | 66598 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 933 | 21 | 8 | 8 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
44383617 | 162481 | 0 | None | - | 0 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 961 | 22 | 8 | 9 | 5.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)c1cnc(C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL405167 | 162481 | 0 | None | - | 0 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 961 | 22 | 8 | 9 | 5.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)c1cnc(C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
10395612 | 113524 | 0 | None | - | 0 | Human | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 814 | 18 | 3 | 7 | 5.7 | CCCCCCCC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
CHEMBL3144339 | 113524 | 0 | None | - | 0 | Human | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 814 | 18 | 3 | 7 | 5.7 | CCCCCCCC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
9801487 | 213777 | 0 | None | - | 1 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | ||
CHEMBL91418 | 213777 | 0 | None | - | 1 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | ||
52937467 | 69297 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
CHEMBL1782141 | 69297 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
44307898 | 208252 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL60504 | 208252 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
10418001 | 113530 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 822 | 14 | 3 | 8 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCc2ccccc2)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144348 | 113530 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 822 | 14 | 3 | 8 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCc2ccccc2)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL439284 | 220610 | 22 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00063a015 | ||||
44307758 | 210335 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL66635 | 210335 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
57391133 | 75142 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 691 | 12 | 3 | 7 | 4.4 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(=O)OCc2ccccc2)C1 | 10.1016/j.ejmech.2011.08.042 | ||
CHEMBL1916635 | 75142 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 691 | 12 | 3 | 7 | 4.4 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(=O)OCc2ccccc2)C1 | 10.1016/j.ejmech.2011.08.042 | ||
10350454 | 113508 | 0 | None | 2 | 4 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144209 | 113508 | 0 | None | 2 | 4 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
10439730 | 113534 | 0 | None | -1 | 4 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144353 | 113534 | 0 | None | -1 | 4 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
44383164 | 172489 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 916 | 21 | 9 | 7 | 5.3 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1c[nH]c([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)n1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL424567 | 172489 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 916 | 21 | 9 | 7 | 5.3 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1c[nH]c([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)n1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL3349620 | 218225 | 11 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | None | None | None | CSCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00053a001 | ||||
118718517 | 122140 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 800 | 12 | 6 | 8 | 1.5 | CSCC[C@@H]1NC(=O)[C@H](CC(C)C)N2C=C[C@@H](NC(=O)[C@H](Cc3ccccc3)N(C)C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](CCC(N)=O)NC1=O)C2=O | 10.1021/jm00053a001 | ||
CHEMBL3349688 | 122140 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 800 | 12 | 6 | 8 | 1.5 | CSCC[C@@H]1NC(=O)[C@H](CC(C)C)N2C=C[C@@H](NC(=O)[C@H](Cc3ccccc3)N(C)C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](CCC(N)=O)NC1=O)C2=O | 10.1021/jm00053a001 | ||
44407901 | 147222 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 701 | 10 | 1 | 6 | 6.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL380928 | 147222 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 701 | 10 | 1 | 6 | 6.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | ||
52937271 | 69295 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
CHEMBL1782139 | 69295 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
132837 | 9018 | 55 | None | 77 | 4 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/S0960-894X(96)00604-X | ||
9461 | 9018 | 55 | None | 77 | 4 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/S0960-894X(96)00604-X | ||
CHEMBL22870 | 9018 | 55 | None | 77 | 4 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/S0960-894X(96)00604-X | ||
52937273 | 69293 | 0 | None | - | 0 | Human | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 458 | 3 | 0 | 2 | 4.7 | CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | ||
CHEMBL1782137 | 69293 | 0 | None | - | 0 | Human | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 458 | 3 | 0 | 2 | 4.7 | CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | ||
10145229 | 15945 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | ||
CHEMBL110219 | 15945 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | ||
10349900 | 113526 | 0 | None | -3 | 4 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144343 | 113526 | 0 | None | -3 | 4 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
10350528 | 113510 | 0 | None | 1 | 4 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
CHEMBL3144210 | 113510 | 0 | None | 1 | 4 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | ||
44384379 | 136425 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 933 | 21 | 8 | 8 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL367312 | 136425 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 933 | 21 | 8 | 8 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)s1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL170299 | 215622 | 0 | None | - | 0 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||||
44408048 | 147336 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 667 | 9 | 1 | 6 | 6.1 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL381157 | 147336 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 667 | 9 | 1 | 6 | 6.1 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | ||
10259370 | 113525 | 0 | None | - | 0 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 730 | 12 | 3 | 7 | 3.4 | CC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
CHEMBL3144340 | 113525 | 0 | None | - | 0 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 730 | 12 | 3 | 7 | 3.4 | CC(=O)n1cc(C[C@@H](NC(=O)C[C@@H]2NC(=O)[C@@H]3C4CCC(CC4)N3C2=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00063a015 | ||
10506928 | 126996 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | ||
CHEMBL352102 | 126996 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | ||
44383616 | 175342 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 917 | 21 | 8 | 8 | 5.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)o1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
CHEMBL435717 | 175342 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 917 | 21 | 8 | 8 | 5.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)c1cnc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)o1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80692-7 | ||
10325464 | 126912 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | ||
CHEMBL351236 | 126912 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | ||
44307821 | 108891 | 0 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
CHEMBL302329 | 108891 | 0 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | ||
44337201 | 115389 | 0 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | ||
CHEMBL320548 | 115389 | 0 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | ||
107686 | 10152 | 41 | None | -3 | 5 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | ||
3522 | 10152 | 41 | None | -3 | 5 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | ||
CHEMBL131171 | 10152 | 41 | None | -3 | 5 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | ||
52937270 | 69294 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 501 | 5 | 2 | 3 | 3.4 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
CHEMBL1782138 | 69294 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 501 | 5 | 2 | 3 | 3.4 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | ||
44408033 | 81547 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 540 | 6 | 1 | 4 | 5.6 | CO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL203111 | 81547 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 540 | 6 | 1 | 4 | 5.6 | CO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | ||
44408047 | 103543 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 597 | 9 | 1 | 5 | 5.5 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN(C)C | 10.1016/j.bmcl.2005.10.077 | ||
CHEMBL264660 | 103543 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 597 | 9 | 1 | 5 | 5.5 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN(C)C | 10.1016/j.bmcl.2005.10.077 | ||
15887537 | 115823 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | ||
CHEMBL321270 | 115823 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | ||
21121353 | 108250 | 0 | None | 16 | 4 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | ||
CHEMBL297776 | 108250 | 0 | None | 16 | 4 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | ||
57392804 | 74759 | 0 | None | - | 0 | Human | 10.3 | pKi | = | 10.3 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911965 | 74759 | 0 | None | - | 0 | Human | 10.3 | pKi | = | 10.3 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911967 | 74759 | 0 | None | - | 0 | Human | 10.3 | pKi | = | 10.3 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57403249 | 78284 | 0 | None | - | 0 | Human | 10.2 | pKi | = | 10.2 | Functional | ChEMBL | 625 | 6 | 1 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2CN(C)C(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911968 | 78284 | 0 | None | - | 0 | Human | 10.2 | pKi | = | 10.2 | Functional | ChEMBL | 625 | 6 | 1 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2CN(C)C(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1962728 | 78284 | 0 | None | - | 0 | Human | 10.2 | pKi | = | 10.2 | Functional | ChEMBL | 625 | 6 | 1 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2CN(C)C(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57396275 | 74758 | 0 | None | - | 0 | Human | 10.1 | pKi | = | 10.1 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911964 | 74758 | 0 | None | - | 0 | Human | 10.1 | pKi | = | 10.1 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
52933155 | 74762 | 0 | None | - | 0 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 641 | 7 | 3 | 5 | 5.5 | Cc1cc(F)ccc1-c1cc(C2CC(=O)NC2(CO)CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911970 | 74762 | 0 | None | - | 0 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 641 | 7 | 3 | 5 | 5.5 | Cc1cc(F)ccc1-c1cc(C2CC(=O)NC2(CO)CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57392804 | 74759 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911965 | 74759 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911967 | 74759 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57396275 | 74758 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911964 | 74758 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57392804 | 74759 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911965 | 74759 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911967 | 74759 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.0 | Cc1cc(F)ccc1-c1cc(C2CNC(=O)C2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57398076 | 74761 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.1 | Cc1cc(F)ccc1-c1cc(C2CC(=O)NC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911969 | 74761 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.1 | Cc1cc(F)ccc1-c1cc(C2CC(=O)NC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57396275 | 74758 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911964 | 74758 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
57396275 | 74758 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
CHEMBL1911964 | 74758 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 611 | 6 | 2 | 4 | 6.3 | Cc1cc(F)ccc1-c1cc(C2NC(=O)CC2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2011.07.116 | ||
2096 | 10416 | 0 | None | 25 | 2 | Guinea pig | 7.1 | pA2 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 1693780 | ||||
2096 | 10416 | 0 | None | 25 | 2 | Guinea pig | 7.1 | pA2 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
25078100 | 10416 | 0 | None | 25 | 2 | Guinea pig | 7.1 | pA2 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 1693780 | ||||
25078100 | 10416 | 0 | None | 25 | 2 | Guinea pig | 7.1 | pA2 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
16131028 | 10417 | 0 | None | 112 | 2 | Guinea pig | 7.6 | pA2 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 1693780 | ||||
16131028 | 10417 | 0 | None | 112 | 2 | Guinea pig | 7.6 | pA2 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
2097 | 10417 | 0 | None | 112 | 2 | Guinea pig | 7.6 | pA2 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 1693780 | ||||
2097 | 10417 | 0 | None | 112 | 2 | Guinea pig | 7.6 | pA2 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
16131028 | 10417 | 0 | None | -112 | 2 | Rat | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
2097 | 10417 | 0 | None | -112 | 2 | Rat | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
2096 | 10416 | 0 | None | -25 | 2 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
25078100 | 10416 | 0 | None | -25 | 2 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | Guide to Pharmacology | None | None | None | None | 1702895 | ||||
135413536 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
230 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
3490 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
6918365 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
CHEMBL1471 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
DB00673 | 7236 | 85 | None | -3 | 3 | Mongolian jird | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
30699 | 224483 | 0 | None | -1 | 14 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 423 | 7 | 2 | 8 | 0.5 | CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)CSC1=CC=NC=C1)C2=O)C(O)=O | None | ||
10328936 | 8328 | 30 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | None | None | ||||
2086 | 8328 | 30 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | None | None | ||||
2955 | 8328 | 30 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | None | None | ||||
CHEMBL373569 | 8328 | 30 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | None | None | ||||
135413538 | 8460 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
4470 | 8460 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
7623 | 8460 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
CHEMBL1199324 | 8460 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
DB06717 | 8460 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | ||
2096 | 10416 | 0 | None | -25 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | Guide to Pharmacology | None | None | None | None | 6208451 | ||||
25078100 | 10416 | 0 | None | -25 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | Guide to Pharmacology | None | None | None | None | 6208451 | ||||
2088 | 8958 | 0 | None | 1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
45749 | 8958 | 0 | None | 1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2101 | 10469 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
155817436 | 9569 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2092 | 9569 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
107686 | 10152 | 41 | None | -3 | 5 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 1281470 | ||
3522 | 10152 | 41 | None | -3 | 5 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 1281470 | ||
CHEMBL131171 | 10152 | 41 | None | -3 | 5 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 1281470 | ||
10328936 | 8328 | 30 | None | 2 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2086 | 8328 | 30 | None | 2 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2955 | 8328 | 30 | None | 2 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
CHEMBL373569 | 8328 | 30 | None | 2 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
3849 | 9968 | 0 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 9243521 | ||||
135413538 | 8460 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | Guide to Pharmacology | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | ||
4470 | 8460 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | Guide to Pharmacology | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | ||
7623 | 8460 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | Guide to Pharmacology | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | ||
CHEMBL1199324 | 8460 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | Guide to Pharmacology | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | ||
DB06717 | 8460 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | Guide to Pharmacology | 614 | 7 | 3 | 7 | 4.4 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1nc(=O)n([nH]1)P(=O)(O)O)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | ||
108167 | 9631 | 8 | None | -58 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 8702757 | ||
2107 | 9631 | 8 | None | -58 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 8702757 | ||
CHEMBL1178725 | 9631 | 8 | None | -58 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | 619 | 9 | 0 | 2 | 8.2 | CC(Oc1cccc(c1)CC(=O)N1CCC[C@](C1)(CC[N+]12CCC(CC1)(CC2)c1ccccc1)c1ccc(c(c1)Cl)Cl)C | 8702757 | ||
17268 | 9891 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2094 | 9891 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
10349 | 9031 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 575 | 8 | 1 | 6 | 5.7 | CN(Cc1n[nH]nc1CN1CCO[C@@H]([C@@H]1c1ccc(cc1)F)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 11708932 | ||
9809077 | 9031 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 575 | 8 | 1 | 6 | 5.7 | CN(Cc1n[nH]nc1CN1CCO[C@@H]([C@@H]1c1ccc(cc1)F)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 11708932 | ||
CHEMBL4303434 | 9031 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 575 | 8 | 1 | 6 | 5.7 | CN(Cc1n[nH]nc1CN1CCO[C@@H]([C@@H]1c1ccc(cc1)F)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 11708932 | ||
3850 | 10259 | 0 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
3086681 | 9052 | 17 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 20533894 | ||
3510 | 9052 | 17 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 20533894 | ||
CHEMBL42407 | 9052 | 17 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 20533894 | ||
2110 | 9743 | 38 | None | -2041 | 3 | Human | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 9042606 | ||
219077 | 9743 | 38 | None | -2041 | 3 | Human | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 9042606 | ||
3480 | 9743 | 38 | None | -2041 | 3 | Human | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 9042606 | ||
CHEMBL346178 | 9743 | 38 | None | -2041 | 3 | Human | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 9042606 | ||
DB04872 | 9743 | 38 | None | -2041 | 3 | Human | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 9042606 | ||
2100 | 10468 | 0 | None | - | 1 | Human | 6.4 | pIC50 | None | 6.4 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2091 | 9571 | 0 | None | -223 | 2 | Human | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2099 | 10467 | 0 | None | - | 1 | Human | 7.9 | pIC50 | None | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2103 | 8424 | 0 | None | - | 1 | Human | 7.9 | pIC50 | None | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 1378096 | ||||
6437864 | 8424 | 0 | None | - | 1 | Human | 7.9 | pIC50 | None | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 1378096 | ||||
132629 | 9017 | 15 | None | - | 1 | Human | 8.3 | pIC50 | None | 8.3 | Functional | Guide to Pharmacology | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 8702757 | ||
2104 | 9017 | 15 | None | - | 1 | Human | 8.3 | pIC50 | None | 8.3 | Functional | Guide to Pharmacology | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 8702757 | ||
CHEMBL24999 | 9017 | 15 | None | - | 1 | Human | 8.3 | pIC50 | None | 8.3 | Functional | Guide to Pharmacology | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 8702757 | ||
168489 | 9890 | 0 | None | - | 1 | Human | 8.4 | pIC50 | None | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2093 | 9890 | 0 | None | - | 1 | Human | 8.4 | pIC50 | None | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 8702757 | ||||
2109 | 10909 | 4 | None | - | 1 | Human | 9.9 | pIC50 | None | 9.9 | Functional | Guide to Pharmacology | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 11408556 | ||
9852253 | 10909 | 4 | None | - | 1 | Human | 9.9 | pIC50 | None | 9.9 | Functional | Guide to Pharmacology | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 11408556 | ||
CHEMBL129683 | 10909 | 4 | None | - | 1 | Human | 9.9 | pIC50 | None | 9.9 | Functional | Guide to Pharmacology | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 11408556 | ||
132837 | 9018 | 55 | None | -83 | 4 | Rat | 6.3 | pIC50 | ~ | 6.3 | Functional | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 | ||
9461 | 9018 | 55 | None | -83 | 4 | Rat | 6.3 | pIC50 | ~ | 6.3 | Functional | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 | ||
CHEMBL22870 | 9018 | 55 | None | -83 | 4 | Rat | 6.3 | pIC50 | ~ | 6.3 | Functional | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 |
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
392622 | 63086 | 95 | None | - | 4 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 720 | 17 | 4 | 9 | 5.9 | CC(C)c1nc(CN(C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)C(C)C)cs1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL163 | 63086 | 95 | None | - | 4 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 720 | 17 | 4 | 9 | 5.9 | CC(C)c1nc(CN(C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)C(C)C)cs1 | 10.1038/s41467-023-40064-9 | |||
3793 | 209988 | 77 | None | - | 1 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1038/s41467-023-40064-9 | |||
45039617 | 209988 | 77 | None | - | 1 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1038/s41467-023-40064-9 | |||
CHEMBL64391 | 209988 | 77 | None | - | 1 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1038/s41467-023-40064-9 | |||
3883 | 190314 | 112 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 369 | 5 | 1 | 4 | 3.5 | Cc1c(OCC(F)(F)F)ccnc1C[S+]([O-])c1nc2ccccc2[nH]1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL480 | 190314 | 112 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 369 | 5 | 1 | 4 | 3.5 | Cc1c(OCC(F)(F)F)ccnc1C[S+]([O-])c1nc2ccccc2[nH]1 | 10.1038/s41467-023-40064-9 | |||
43815 | 193699 | 64 | None | - | 25 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL1708 | 193699 | 64 | None | - | 25 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL490 | 193699 | 64 | None | - | 25 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
1890 | 9535 | 49 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
4449 | 9535 | 49 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
7247 | 9535 | 49 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
CHEMBL623 | 9535 | 49 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
DB01149 | 9535 | 49 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
191 | 7191 | 98 | None | - | 29 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
201 | 7191 | 98 | None | - | 29 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
2170 | 7191 | 98 | None | - | 29 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL1113 | 7191 | 98 | None | - | 29 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
DB00543 | 7191 | 98 | None | - | 29 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
212 | 10578 | 47 | None | - | 25 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
2639 | 10578 | 47 | None | - | 25 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
941651 | 10578 | 47 | None | - | 25 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL1201 | 10578 | 47 | None | - | 25 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
DB01623 | 10578 | 47 | None | - | 25 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
2247 | 7293 | 81 | None | -117 | 42 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
249 | 7293 | 81 | None | -117 | 42 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
2603 | 7293 | 81 | None | -117 | 42 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL296419 | 7293 | 81 | None | -117 | 42 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
DB00637 | 7293 | 81 | None | -117 | 42 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
2585 | 7590 | 103 | None | - | 22 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 406 | 10 | 3 | 5 | 3.7 | COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O | 10.1038/s41467-023-40064-9 | |||
522 | 7590 | 103 | None | - | 22 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 406 | 10 | 3 | 5 | 3.7 | COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O | 10.1038/s41467-023-40064-9 | |||
551 | 7590 | 103 | None | - | 22 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 406 | 10 | 3 | 5 | 3.7 | COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O | 10.1038/s41467-023-40064-9 | |||
CHEMBL723 | 7590 | 103 | None | - | 22 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 406 | 10 | 3 | 5 | 3.7 | COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O | 10.1038/s41467-023-40064-9 | |||
DB01136 | 7590 | 103 | None | - | 22 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 406 | 10 | 3 | 5 | 3.7 | COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O | 10.1038/s41467-023-40064-9 | |||
11434515 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
11519741 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
4484 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
7449 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL1194325 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
DB08897 | 7049 | 6 | None | - | 5 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
213 | 10625 | 55 | None | - | 43 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
2717 | 10625 | 55 | None | - | 43 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
5533 | 10625 | 55 | None | - | 43 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL621 | 10625 | 55 | None | - | 43 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
DB00656 | 10625 | 55 | None | - | 43 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
10034073 | 23933 | 29 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 1056 | 13 | 7 | 18 | 6.2 | CCc1c(Cl)c(O)c(Cl)c(O)c1C(=O)O[C@H]1[C@H](O)[C@H](OC)[C@H](OC/C2=C\C=C\C[C@H](O)/C(C)=C/[C@H](CC)[C@@H](O[C@@H]3OC(C)(C)[C@@H](OC(=O)C(C)C)[C@H](O)[C@@H]3O)/C(C)=C/C(C)=C/C[C@@H]([C@@H](C)O)OC2=O)O[C@@H]1C | 10.1038/s41467-023-40064-9 | |||
CHEMBL1255800 | 23933 | 29 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 1056 | 13 | 7 | 18 | 6.2 | CCc1c(Cl)c(O)c(Cl)c(O)c1C(=O)O[C@H]1[C@H](O)[C@H](OC)[C@H](OC/C2=C\C=C\C[C@H](O)/C(C)=C/[C@H](CC)[C@@H](O[C@@H]3OC(C)(C)[C@@H](OC(=O)C(C)C)[C@H](O)[C@@H]3O)/C(C)=C/C(C)=C/C[C@@H]([C@@H](C)O)OC2=O)O[C@@H]1C | 10.1038/s41467-023-40064-9 | |||
2600 | 10551 | 74 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
2608 | 10551 | 74 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
5405 | 10551 | 74 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
CHEMBL17157 | 10551 | 74 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
DB00342 | 10551 | 74 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
644241 | 101961 | 121 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 529 | 6 | 2 | 7 | 6.4 | Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL255863 | 101961 | 121 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 529 | 6 | 2 | 7 | 6.4 | Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1 | 10.1038/s41467-023-40064-9 | |||
5360696 | 8188 | 30 | None | - | 3 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 271 | 1 | 0 | 2 | 3.4 | COc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C | 10.1038/s41467-023-40064-9 | |||
6953 | 8188 | 30 | None | - | 3 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 271 | 1 | 0 | 2 | 3.4 | COc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C | 10.1038/s41467-023-40064-9 | |||
842 | 8188 | 30 | None | - | 3 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 271 | 1 | 0 | 2 | 3.4 | COc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL52440 | 8188 | 30 | None | - | 3 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 271 | 1 | 0 | 2 | 3.4 | COc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C | 10.1038/s41467-023-40064-9 | |||
DB00514 | 8188 | 30 | None | - | 3 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 271 | 1 | 0 | 2 | 3.4 | COc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C | 10.1038/s41467-023-40064-9 | |||
5328940 | 106992 | 107 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 529 | 9 | 1 | 8 | 5.2 | COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl | 10.1038/s41467-023-40064-9 | |||
CHEMBL288441 | 106992 | 107 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 529 | 9 | 1 | 8 | 5.2 | COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl | 10.1038/s41467-023-40064-9 | |||
3157 | 8252 | 71 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 451 | 4 | 2 | 8 | 1.5 | COc1cc2nc([nH]c(=N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2 | 10.1038/s41467-023-40064-9 | |||
7170 | 8252 | 71 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 451 | 4 | 2 | 8 | 1.5 | COc1cc2nc([nH]c(=N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2 | 10.1038/s41467-023-40064-9 | |||
954 | 8252 | 71 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 451 | 4 | 2 | 8 | 1.5 | COc1cc2nc([nH]c(=N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL707 | 8252 | 71 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 451 | 4 | 2 | 8 | 1.5 | COc1cc2nc([nH]c(=N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2 | 10.1038/s41467-023-40064-9 | |||
DB00590 | 8252 | 71 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 451 | 4 | 2 | 8 | 1.5 | COc1cc2nc([nH]c(=N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2 | 10.1038/s41467-023-40064-9 | |||
1353 | 8692 | 93 | None | - | 85 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
3559 | 8692 | 93 | None | - | 85 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
86 | 8692 | 93 | None | - | 85 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
CHEMBL54 | 8692 | 93 | None | - | 85 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
DB00502 | 8692 | 93 | None | - | 85 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
242 | 7258 | 124 | None | - | 51 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
34 | 7258 | 124 | None | - | 51 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
60795 | 7258 | 124 | None | - | 51 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
CHEMBL1112 | 7258 | 124 | None | - | 51 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
DB01238 | 7258 | 124 | None | - | 51 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
1024 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
162639143 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
5284373 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
760 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
CHEMBL160 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
DB00091 | 8072 | 71 | None | - | 1 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000093v | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000093v | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000093v | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000093v | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000093v | |||||
CHEMBL384518 | 219107 | 12 | None | - | 0 | Human | 9.2 | pEC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(N)=O | 10.1021/jm000093v | |||||
CHEMBL428532 | 220234 | 6 | None | - | 0 | Guinea pig | 8.8 | pEC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(N)=O | 10.1021/jm00157a029 | |||||
44337561 | 103513 | 0 | None | - | 0 | Guinea pig | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 921 | 19 | 9 | 10 | -0.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL264395 | 103513 | 0 | None | - | 0 | Guinea pig | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 921 | 19 | 9 | 10 | -0.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
44308430 | 109040 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 921 | 19 | 9 | 10 | -0.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
CHEMBL303222 | 109040 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 921 | 19 | 9 | 10 | -0.2 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
CHEMBL2371799 | 216906 | 0 | None | - | 0 | Guinea pig | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(N)=O | 10.1021/jm00157a029 | |||||
CHEMBL263185 | 217340 | 5 | None | - | 0 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm000093v | |||||
CHEMBL415159 | 219954 | 5 | None | - | 0 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1021/jm000093v | |||||
44337560 | 116527 | 0 | None | - | 0 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 950 | 19 | 9 | 10 | 0.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCCCCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL323028 | 116527 | 0 | None | - | 0 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 950 | 19 | 9 | 10 | 0.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCCCCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
44337787 | 15939 | 0 | None | - | 0 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 907 | 19 | 9 | 10 | -0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL110177 | 15939 | 0 | None | - | 0 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 907 | 19 | 9 | 10 | -0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
44308431 | 171301 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 907 | 19 | 9 | 10 | -0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
CHEMBL421485 | 171301 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 907 | 19 | 9 | 10 | -0.6 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
CHEMBL2371799 | 216906 | 0 | None | - | 0 | Guinea pig | 8.7 | pEC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(N)=O | 10.1021/jm00157a029 | |||||
132629 | 9017 | 15 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/np058114h | |||
2104 | 9017 | 15 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/np058114h | |||
CHEMBL24999 | 9017 | 15 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/np058114h | |||
CHEMBL422779 | 220092 | 0 | None | - | 0 | Guinea pig | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(N)=O | 10.1021/jm960154i | |||||
CHEMBL106184 | 215249 | 0 | None | - | 0 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN(CCCN)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(N)=O | 10.1021/jm960154i | |||||
108147 | 10355 | 36 | None | - | 3 | Guinea pig | 4.5 | pEC50 | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960154i | |||||
2127 | 10355 | 36 | None | - | 3 | Guinea pig | 4.5 | pEC50 | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960154i | |||||
CHEMBL106124 | 10355 | 36 | None | - | 3 | Guinea pig | 4.5 | pEC50 | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960154i | |||||
CHEMBL428532 | 220234 | 6 | None | - | 0 | Guinea pig | 8.4 | pEC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(N)=O | 10.1021/jm00157a029 | |||||
10843656 | 103597 | 0 | None | - | 0 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | 1009 | 34 | 10 | 11 | -0.1 | CNC(=O)CCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(C)=O)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm960154i | |||
CHEMBL265115 | 103597 | 0 | None | - | 0 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | 1009 | 34 | 10 | 11 | -0.1 | CNC(=O)CCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(C)=O)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm960154i | |||
44337775 | 170186 | 0 | None | - | 0 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 893 | 19 | 9 | 10 | -1.0 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL419558 | 170186 | 0 | None | - | 0 | Guinea pig | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 893 | 19 | 9 | 10 | -1.0 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCNC(=O)CCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
44337797 | 115791 | 0 | None | - | 0 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 936 | 19 | 9 | 10 | 0.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL321228 | 115791 | 0 | None | - | 0 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 936 | 19 | 9 | 10 | 0.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
44308550 | 108895 | 0 | None | - | 0 | Human | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 936 | 19 | 9 | 10 | 0.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
CHEMBL302349 | 108895 | 0 | None | - | 0 | Human | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 936 | 19 | 9 | 10 | 0.1 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCNC(=O)CCCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm00040a005 | |||
162673403 | 189828 | 0 | None | - | 0 | Human | 5.3 | pEC50 | = | 5.3 | Binding | ChEMBL | 3435 | 125 | 39 | 39 | 2.9 | CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC | 10.1016/j.bmcl.2020.127353 | |||
CHEMBL4794099 | 189828 | 0 | None | - | 0 | Human | 5.3 | pEC50 | = | 5.3 | Binding | ChEMBL | 3435 | 125 | 39 | 39 | 2.9 | CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC | 10.1016/j.bmcl.2020.127353 | |||
44337530 | 174676 | 0 | None | - | 0 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 964 | 19 | 9 | 10 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCCCCNC(=O)CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
CHEMBL431243 | 174676 | 0 | None | - | 0 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 964 | 19 | 9 | 10 | 0.9 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN1CCCCCCNC(=O)CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C1=O)C(N)=O | 10.1021/jm960154i | |||
162651127 | 187060 | 0 | None | - | 0 | Human | 5.1 | pEC50 | = | 5.1 | Binding | ChEMBL | 2299 | 83 | 25 | 24 | 7.8 | CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(N)=O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC | 10.1016/j.bmcl.2020.127353 | |||
CHEMBL4750714 | 187060 | 0 | None | - | 0 | Human | 5.1 | pEC50 | = | 5.1 | Binding | ChEMBL | 2299 | 83 | 25 | 24 | 7.8 | CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(N)=O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC | 10.1016/j.bmcl.2020.127353 | |||
11238415 | 106030 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11 | Binding | ChEMBL | 566 | 5 | 1 | 2 | 7.8 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CBr)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL281797 | 106030 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11 | Binding | ChEMBL | 566 | 5 | 1 | 2 | 7.8 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CBr)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
11352855 | 103891 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11.0 | Binding | ChEMBL | 517 | 6 | 2 | 3 | 6.6 | CNCc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL26761 | 103891 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11.0 | Binding | ChEMBL | 517 | 6 | 2 | 3 | 6.6 | CNCc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
9821217 | 114507 | 21 | None | - | 0 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL319118 | 114507 | 21 | None | - | 0 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL3215877 | 114507 | 21 | None | - | 0 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
49863731 | 22102 | 0 | None | - | 3 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
CHEMBL1214024 | 22102 | 0 | None | - | 3 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
25129133 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
CHEMBL507340 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
25129133 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL507340 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
25129133 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
CHEMBL507340 | 195666 | 0 | None | - | 4 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
46884430 | 15092 | 0 | None | - | 0 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CN2C(=O)C=CCC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1092755 | 15092 | 0 | None | - | 0 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CN2C(=O)C=CCC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
11852872 | 75402 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917864 | 75402 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
25027805 | 77797 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.8 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951813 | 77797 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.8 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
44178113 | 68038 | 0 | None | - | 3 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766208 | 68038 | 0 | None | - | 3 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
57391771 | 77795 | 0 | None | - | 0 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 547 | 4 | 1 | 3 | 4.2 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951810 | 77795 | 0 | None | - | 0 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 547 | 4 | 1 | 3 | 4.2 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
57395695 | 78397 | 0 | None | - | 0 | Human | 10.6 | pIC50 | = | 10.6 | Binding | ChEMBL | 559 | 10 | 2 | 8 | 3.1 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917866 | 78397 | 0 | None | - | 0 | Human | 10.6 | pIC50 | = | 10.6 | Binding | ChEMBL | 559 | 10 | 2 | 8 | 3.1 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963416 | 78397 | 0 | None | - | 0 | Human | 10.6 | pIC50 | = | 10.6 | Binding | ChEMBL | 559 | 10 | 2 | 8 | 3.1 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
87318292 | 133230 | 0 | None | - | 0 | Human | 10.6 | pIC50 | = | 10.6 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
CHEMBL3651897 | 133230 | 0 | None | - | 0 | Human | 10.6 | pIC50 | = | 10.6 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
67232184 | 133224 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 548 | 4 | 0 | 3 | 4.9 | CC(=O)N1CCC(C(=O)N2C[C@@H](N(C)C(=O)N(C)c3cc(Cl)cc(Cl)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
CHEMBL3651891 | 133224 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 548 | 4 | 0 | 3 | 4.9 | CC(=O)N1CCC(C(=O)N2C[C@@H](N(C)C(=O)N(C)c3cc(Cl)cc(Cl)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
73265457 | 133229 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 653 | 4 | 0 | 4 | 4.5 | CN(C(=O)N(C)[C@@H]1CN(C(=O)N2CCN(S(C)(=O)=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3651896 | 133229 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 653 | 4 | 0 | 4 | 4.5 | CN(C(=O)N(C)[C@@H]1CN(C(=O)N2CCN(S(C)(=O)=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
11248796 | 168428 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 488 | 4 | 0 | 2 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1cnc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL413027 | 168428 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 488 | 4 | 0 | 2 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1cnc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
122182823 | 128839 | 0 | None | - | 0 | Mongolian jird | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 433 | 6 | 1 | 7 | 3.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596448 | 128839 | 0 | None | - | 0 | Mongolian jird | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 433 | 6 | 1 | 7 | 3.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
44433804 | 153573 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392466 | 153573 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
73265450 | 133220 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 680 | 4 | 0 | 3 | 7.2 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3651887 | 133220 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 680 | 4 | 0 | 3 | 7.2 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
73265453 | 133225 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 617 | 4 | 0 | 4 | 5.0 | CC(=O)N1CCC(C(=O)N2CC(c3ccc(F)cn3)[C@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
CHEMBL3651892 | 133225 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 617 | 4 | 0 | 4 | 5.0 | CC(=O)N1CCC(C(=O)N2CC(c3ccc(F)cn3)[C@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
57402264 | 77735 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccccc3C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951626 | 77735 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccccc3C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
57403992 | 77742 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 519 | 4 | 1 | 2 | 5.3 | Cc1cc(F)ccc1[C@H]1CN(C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951633 | 77742 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 519 | 4 | 1 | 2 | 5.3 | Cc1cc(F)ccc1[C@H]1CN(C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
73265456 | 133228 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 590 | 4 | 1 | 3 | 5.7 | CN(C(=O)N(C)[C@@H]1CN(C(=O)NC2CCOCC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3651895 | 133228 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 590 | 4 | 1 | 3 | 5.7 | CN(C(=O)N(C)[C@@H]1CN(C(=O)NC2CCOCC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
9828716 | 78408 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 503 | 7 | 2 | 7 | 3.4 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917853 | 78408 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 503 | 7 | 2 | 7 | 3.4 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963487 | 78408 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 503 | 7 | 2 | 7 | 3.4 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
127944 | 127703 | 3 | None | - | 1 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL356062 | 127703 | 3 | None | - | 1 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL555572 | 127703 | 3 | None | - | 1 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
46881682 | 14869 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1091469 | 14869 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46883879 | 14542 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 626 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089271 | 14542 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 626 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
57398784 | 77740 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 575 | 6 | 1 | 3 | 4.9 | CC(=O)NCC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951631 | 77740 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 575 | 6 | 1 | 3 | 4.9 | CC(=O)NCC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
57400919 | 78394 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 529 | 8 | 2 | 7 | 3.9 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC2CC2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917856 | 78394 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 529 | 8 | 2 | 7 | 3.9 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC2CC2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963413 | 78394 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 529 | 8 | 2 | 7 | 3.9 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC2CC2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
57397000 | 77796 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 563 | 4 | 2 | 4 | 4.3 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(=O)NO)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951811 | 77796 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 563 | 4 | 2 | 4 | 4.3 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(=O)NO)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
11621512 | 77739 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 629 | 5 | 0 | 3 | 6.0 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951630 | 77739 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 629 | 5 | 0 | 3 | 6.0 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
57397022 | 77741 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 533 | 4 | 1 | 2 | 5.6 | CNC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951632 | 77741 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 533 | 4 | 1 | 2 | 5.6 | CNC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
73265454 | 133226 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 646 | 5 | 1 | 4 | 6.3 | COC(=O)N[C@H]1CC[C@H](C(=O)N2C[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
CHEMBL3651893 | 133226 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 646 | 5 | 1 | 4 | 6.3 | COC(=O)N[C@H]1CC[C@H](C(=O)N2C[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
57400917 | 78422 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 474 | 6 | 1 | 7 | 3.2 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917852 | 78422 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 474 | 6 | 1 | 7 | 3.2 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963577 | 78422 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 474 | 6 | 1 | 7 | 3.2 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
135539114 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm9506534 | |||
CHEMBL99055 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm9506534 | |||
135539114 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/acs.jmedchem.1c00790 | |||
CHEMBL99055 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/acs.jmedchem.1c00790 | |||
122182821 | 128837 | 0 | None | - | 0 | Mongolian jird | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 365 | 6 | 1 | 7 | 2.7 | COc1ccc(-n2cnnn2)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596446 | 128837 | 0 | None | - | 0 | Mongolian jird | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 365 | 6 | 1 | 7 | 2.7 | COc1ccc(-n2cnnn2)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
122182822 | 128838 | 0 | None | - | 0 | Mongolian jird | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 379 | 6 | 1 | 7 | 3.0 | COc1ccc(-n2nnnc2C)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596447 | 128838 | 0 | None | - | 0 | Mongolian jird | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 379 | 6 | 1 | 7 | 3.0 | COc1ccc(-n2nnnc2C)cc1CO[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2015.04.098 | |||
44433798 | 152464 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391615 | 152464 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44433797 | 152914 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391964 | 152914 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
24752718 | 13315 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1082896 | 13315 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
135539114 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm0311487 | |||
CHEMBL99055 | 215081 | 3 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm0311487 | |||
57398783 | 77738 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.7 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951629 | 77738 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.7 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
57391771 | 77795 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 547 | 4 | 1 | 3 | 4.2 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951810 | 77795 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 547 | 4 | 1 | 3 | 4.2 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
57395688 | 75400 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 490 | 6 | 1 | 8 | 3.4 | COC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917851 | 75400 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 490 | 6 | 1 | 8 | 3.4 | COC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
57390405 | 78396 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 545 | 9 | 2 | 8 | 2.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917865 | 78396 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 545 | 9 | 2 | 8 | 2.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963415 | 78396 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 545 | 9 | 2 | 8 | 2.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CCNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57397483 | 78395 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 515 | 7 | 2 | 7 | 3.5 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC2CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917859 | 78395 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 515 | 7 | 2 | 7 | 3.5 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC2CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963414 | 78395 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 515 | 7 | 2 | 7 | 3.5 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC2CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57400921 | 78383 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NCC(F)(F)F)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917860 | 78383 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NCC(F)(F)F)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963300 | 78383 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NCC(F)(F)F)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57395693 | 78384 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CN(C(C)=O)C2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917862 | 78384 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CN(C(C)=O)C2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963301 | 78384 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 557 | 7 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CN(C(C)=O)C2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
44456802 | 104226 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 476 | 4 | 1 | 2 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)NC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL270090 | 104226 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 476 | 4 | 1 | 2 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)NC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
16663280 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL272649 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
23653789 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
9280 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
CHEMBL447955 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
DB12973 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
46881727 | 12366 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3ccn[nH]3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077241 | 12366 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3ccn[nH]3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46881779 | 15222 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093750 | 15222 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52949827 | 24114 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257357 | 24114 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
25028925 | 98140 | 4 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 5.5 | Cc1ccccc1[C@@H]1[C@@H](O[C@H](CO)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H]2CN(C3=NC(=O)CO3)C[C@H]21 | 10.1021/jm400751p | |||
CHEMBL2402572 | 98140 | 4 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 5.5 | Cc1ccccc1[C@@H]1[C@@H](O[C@H](CO)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H]2CN(C3=NC(=O)CO3)C[C@H]21 | 10.1021/jm400751p | |||
16663280 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
16663280 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL272649 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL272649 | 104737 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
23653789 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
9280 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
CHEMBL447955 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
DB12973 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
44444666 | 161163 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 506 | 5 | 1 | 2 | 6.5 | CC(C)NC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL398720 | 161163 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 506 | 5 | 1 | 2 | 6.5 | CC(C)NC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
127944 | 127703 | 3 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL356062 | 127703 | 3 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL555572 | 127703 | 3 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
57391807 | 77736 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 625 | 6 | 0 | 3 | 6.1 | CCc1ccccc1[C@H]1CN(C(=O)C2CCN(C(C)=O)CC2)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951627 | 77736 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 625 | 6 | 0 | 3 | 6.1 | CCc1ccccc1[C@H]1CN(C(=O)C2CCN(C(C)=O)CC2)CC[C@@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
24889113 | 14720 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090450 | 14720 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1204418 | 14720 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52943848 | 24192 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257588 | 24192 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
135406581 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1016/j.bmcl.2018.09.016 | |||
CHEMBL140745 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1016/j.bmcl.2018.09.016 | |||
73265455 | 133227 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 660 | 5 | 1 | 4 | 5.4 | CN(C(=O)N(C)[C@@H]1CN(C(=O)C2CCN(C(=O)C(C)(C)O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3651894 | 133227 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 660 | 5 | 1 | 4 | 5.4 | CN(C(=O)N(C)[C@@H]1CN(C(=O)C2CCN(C(=O)C(C)(C)O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
2098 | 10466 | 36 | None | -2 | 6 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
36511 | 10466 | 36 | None | -2 | 6 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3805 | 10466 | 36 | None | -2 | 6 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3835 | 10466 | 36 | None | -2 | 6 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL235363 | 10466 | 36 | None | -2 | 6 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
135406581 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1021/jm980299k | |||
CHEMBL140745 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1021/jm980299k | |||
44433800 | 153567 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392463 | 153567 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44433803 | 153572 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392465 | 153572 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
24752718 | 13315 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1082896 | 13315 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46881820 | 14333 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(n3cnnc3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1087695 | 14333 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(n3cnnc3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46881729 | 14711 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090421 | 14711 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46881779 | 15222 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093750 | 15222 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44444634 | 100876 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 463 | 4 | 0 | 2 | 6.0 | CC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249145 | 100876 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 463 | 4 | 0 | 2 | 6.0 | CC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
24180495 | 161461 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 483 | 5 | 0 | 3 | 6.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL399668 | 161461 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 483 | 5 | 0 | 3 | 6.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444643 | 161680 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 574 | 5 | 0 | 3 | 6.2 | CC(=O)N1CCC(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400848 | 161680 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 574 | 5 | 0 | 3 | 6.2 | CC(=O)N1CCC(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmcl.2007.06.085 | |||
135406581 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1021/jm800219f | |||
CHEMBL140745 | 38701 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 520 | 6 | 2 | 5 | 4.4 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccc(F)cc2)[nH]1 | 10.1021/jm800219f | |||
73265452 | 133223 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 609 | 4 | 0 | 4 | 5.8 | CN(C(=O)N(C)[C@@H]1CCN(C2CCS(=O)(=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3651890 | 133223 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 609 | 4 | 0 | 4 | 5.8 | CN(C(=O)N(C)[C@@H]1CCN(C2CCS(=O)(=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
11852872 | 75402 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917864 | 75402 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57402266 | 77743 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 549 | 5 | 1 | 3 | 5.5 | CONC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951634 | 77743 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 549 | 5 | 1 | 3 | 5.5 | CONC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
73265451 | 133222 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 666 | 4 | 0 | 3 | 6.8 | CC(=O)N1CCC(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)[C@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
CHEMBL3651889 | 133222 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 666 | 4 | 0 | 3 | 6.8 | CC(=O)N1CCC(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)[C@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
11409185 | 106199 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL282853 | 106199 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
57402690 | 75399 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 510 | 7 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(S(C)(=O)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917850 | 75399 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 510 | 7 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(S(C)(=O)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
9917079 | 67939 | 39 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 619 | 5 | 1 | 3 | 7.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccc(Cl)cc2)C1)c1ccnc2ccccc12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765508 | 67939 | 39 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 619 | 5 | 1 | 3 | 7.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccc(Cl)cc2)C1)c1ccnc2ccccc12 | 10.1016/j.bmc.2011.02.031 | |||
5752 | 10777 | 24 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm980299k | |||
6918331 | 10777 | 24 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm980299k | |||
CHEMBL522302 | 10777 | 24 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm980299k | |||
DB12436 | 10777 | 24 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm980299k | |||
71456209 | 85432 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 457 | 4 | 1 | 7 | 4.0 | COc1ccc(-n2nnnc2C(F)(F)F)cc1C1=CC2(CCCN[C@H]2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL2112366 | 85432 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 457 | 4 | 1 | 7 | 4.0 | COc1ccc(-n2nnnc2C(F)(F)F)cc1C1=CC2(CCCN[C@H]2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
46881729 | 14711 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090421 | 14711 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24750888 | 15223 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 504 | 4 | 1 | 3 | 5.4 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093751 | 15223 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 504 | 4 | 1 | 3 | 5.4 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24752434 | 15905 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1099372 | 15905 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
52941351 | 24150 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257466 | 24150 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
57395691 | 78423 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 7 | 2 | 7 | 3.8 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917858 | 78423 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 7 | 2 | 7 | 3.8 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963578 | 78423 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 7 | 2 | 7 | 3.8 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)NC(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57400923 | 78398 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 545 | 8 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CN(C)C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917867 | 78398 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 545 | 8 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CN(C)C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963417 | 78398 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 545 | 8 | 1 | 8 | 2.6 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)CN(C)C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
10407571 | 174736 | 10 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL431690 | 174736 | 10 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
57397481 | 78429 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 8 | 2 | 7 | 3.8 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OCC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917855 | 78429 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 8 | 2 | 7 | 3.8 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OCC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963613 | 78429 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 517 | 8 | 2 | 7 | 3.8 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OCC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmc.2013.09.001 | |||
11983278 | 172879 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1NC(=O)CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL425956 | 172879 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1NC(=O)CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmc.2013.09.001 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2018.09.016 | |||
11983278 | 172879 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1NC(=O)CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL425956 | 172879 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1NC(=O)CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.02.080 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/acs.jmedchem.1c00790 | |||
135449286 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/acs.jmedchem.1c00790 | |||
CHEMBL52330 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/acs.jmedchem.1c00790 | |||
135449286 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm950654w | |||
CHEMBL52330 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm950654w | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm980299k | |||
135485796 | 42024 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 516 | 6 | 2 | 6 | 5.2 | C[C@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
CHEMBL143587 | 42024 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 516 | 6 | 2 | 6 | 5.2 | C[C@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
135449286 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm980299k | |||
CHEMBL52330 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm980299k | |||
44407331 | 147991 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 557 | 10 | 3 | 6 | 3.9 | CS(=O)(=O)NCC1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL382848 | 147991 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 557 | 10 | 3 | 6 | 3.9 | CS(=O)(=O)NCC1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
135413536 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
230 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
3490 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
6918365 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL1471 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
DB00673 | 7236 | 85 | None | - | 2 | Mongolian jird | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2015.04.098 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2007.08.028 | |||
44433799 | 95443 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 5.8 | Cc1cnc(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL235882 | 95443 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 5.8 | Cc1cnc(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.035 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2006.06.044 | |||
135449286 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL52330 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1016/j.bmcl.2006.06.035 | |||
24888943 | 14719 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 571 | 5 | 0 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090438 | 14719 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 571 | 5 | 0 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
46881682 | 14869 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1091469 | 14869 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
52947645 | 24015 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256586 | 24015 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52948590 | 24079 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257235 | 24079 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24993313 | 193810 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 532 | 4 | 1 | 2 | 6.8 | CNC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
CHEMBL490869 | 193810 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 532 | 4 | 1 | 2 | 6.8 | CNC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
44444631 | 100875 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 445 | 4 | 0 | 2 | 5.8 | CC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249144 | 100875 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 445 | 4 | 0 | 2 | 5.8 | CC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
44444637 | 101276 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 5 | 0 | 2 | 6.3 | CCC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL251577 | 101276 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 477 | 5 | 0 | 2 | 6.3 | CCC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
44444685 | 161551 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)=CC1=O | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400148 | 161551 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)=CC1=O | 10.1016/j.bmcl.2007.06.085 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm0109558 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm800219f | |||
135547943 | 41201 | 26 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 4.8 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800219f | |||
CHEMBL142819 | 41201 | 26 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 4.8 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800219f | |||
135449286 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm800219f | |||
CHEMBL52330 | 199968 | 2 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 502 | 6 | 2 | 5 | 4.3 | O=c1[nH]nc(CN2CCO[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm800219f | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm990617v | |||
42611207 | 131564 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 651 | 4 | 0 | 3 | 6.7 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642163 | 131564 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 651 | 4 | 0 | 3 | 6.7 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
57399171 | 75401 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 515 | 6 | 2 | 7 | 3.3 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)cc3c2OCC3)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917857 | 75401 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 515 | 6 | 2 | 7 | 3.3 | CCNC(=O)N1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)cc3c2OCC3)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
57398782 | 77730 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 597 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951621 | 77730 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 597 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/s0960-894x(02)00563-2 | |||
135539114 | 215081 | 3 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm9700171 | |||
CHEMBL99055 | 215081 | 3 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 500 | 6 | 2 | 4 | 5.1 | O=c1[nH]nc(CN2CCC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)[nH]1 | 10.1021/jm9700171 | |||
CHEMBL5290533 | 201279 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 479 | 4 | 1 | 8 | 3.4 | COc1cccc(-n2nnnc2C(F)(F)F)c1[C@H]1CO[C@@]2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
135419433 | 38570 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 466 | 6 | 2 | 6 | 4.3 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
CHEMBL140626 | 38570 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 466 | 6 | 2 | 6 | 4.3 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cc(F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
44407427 | 147958 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 432 | 7 | 2 | 4 | 5.0 | FC(F)(F)Oc1ccc(OC2CC2)c(CNC2CCC3CCC2(c2ccccc2)N3)c1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL382803 | 147958 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 432 | 7 | 2 | 4 | 5.0 | FC(F)(F)Oc1ccc(OC2CC2)c(CNC2CCC3CCC2(c2ccccc2)N3)c1 | 10.1016/j.bmcl.2005.11.026 | |||
44318589 | 170122 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 493 | 4 | 1 | 8 | 3.4 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL419119 | 170122 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 493 | 4 | 1 | 8 | 3.4 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
136094861 | 212588 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 590 | 6 | 2 | 11 | 3.2 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN(Cc1n[nH]c(O)n1)[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL83250 | 212588 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 590 | 6 | 2 | 11 | 3.2 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN(Cc1n[nH]c(O)n1)[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
136094863 | 113912 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 556 | 6 | 2 | 10 | 3.8 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3n[nH]c(O)n3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL316141 | 113912 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 556 | 6 | 2 | 10 | 3.8 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3n[nH]c(O)n3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
57393955 | 78372 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 585 | 7 | 1 | 8 | 3.4 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CCN(C(C)=O)CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917863 | 78372 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 585 | 7 | 1 | 8 | 3.4 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CCN(C(C)=O)CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963216 | 78372 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 585 | 7 | 1 | 8 | 3.4 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)C2CCN(C(C)=O)CC2)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
46830287 | 14762 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[n+]([O-])cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090648 | 14762 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[n+]([O-])cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24993314 | 177818 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | CC1=C(N2C[C@H]3CC[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3C2)CCC1=O | 10.1021/jm8016514 | |||
CHEMBL445686 | 177818 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | CC1=C(N2C[C@H]3CC[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3C2)CCC1=O | 10.1021/jm8016514 | |||
44444664 | 101253 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 492 | 5 | 1 | 2 | 6.1 | CCNC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL251387 | 101253 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 492 | 5 | 1 | 2 | 6.1 | CCNC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
73265449 | 131190 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 630 | 4 | 0 | 3 | 6.0 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
CHEMBL3639507 | 131190 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 630 | 4 | 0 | 3 | 6.0 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)N(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | nan | |||
10051762 | 89004 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 501 | 6 | 0 | 4 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21709 | 89004 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 501 | 6 | 0 | 4 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44407513 | 81072 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 462 | 8 | 3 | 5 | 4.2 | OCC1CC2(c3ccccc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL202417 | 81072 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 462 | 8 | 3 | 5 | 4.2 | OCC1CC2(c3ccccc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
10004377 | 118185 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 459 | 4 | 1 | 7 | 4.1 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCNC2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL327250 | 118185 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 459 | 4 | 1 | 7 | 4.1 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCNC2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
44325058 | 119229 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 539 | 6 | 1 | 8 | 4.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3c[nH]cn3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL329828 | 119229 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 539 | 6 | 1 | 8 | 4.7 | COc1ccc(-n2nnnc2C(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3c[nH]cn3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.bmc.2016.03.006 | |||||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.bmc.2016.11.014 | |||||
57398785 | 77744 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.5 | CNC(=O)C(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951635 | 77744 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.5 | CNC(=O)C(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1016/j.bmc.2011.11.048 | |||
24889113 | 14720 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090450 | 14720 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1204418 | 14720 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46884518 | 14750 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 554 | 5 | 0 | 4 | 6.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ncco3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090547 | 14750 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 554 | 5 | 0 | 4 | 6.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ncco3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46884467 | 14763 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 582 | 5 | 0 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccnc(F)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090649 | 14763 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 582 | 5 | 0 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccnc(F)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46884519 | 14865 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 7.4 | Cc1noc(C)c1C1=CC(=O)N2C[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2C1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091342 | 14865 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 7.4 | Cc1noc(C)c1C1=CC(=O)N2C[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2C1 | 10.1016/j.bmcl.2010.01.120 | |||
52943994 | 24604 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258967 | 24604 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24993955 | 191084 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 517 | 4 | 0 | 2 | 7.0 | CC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
CHEMBL484134 | 191084 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 517 | 4 | 0 | 2 | 7.0 | CC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
44444681 | 101148 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 501 | 5 | 0 | 3 | 6.7 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL250798 | 101148 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 501 | 5 | 0 | 3 | 6.7 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444688 | 161783 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(=O)C=C1N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL401415 | 161783 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(=O)C=C1N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
44444658 | 173843 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 478 | 4 | 1 | 2 | 5.7 | CNC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL428933 | 173843 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 478 | 4 | 1 | 2 | 5.7 | CNC(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
45271306 | 202451 | 0 | None | 14 | 4 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL556537 | 202451 | 0 | None | 14 | 4 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm034219a | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm034219a | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm034219a | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm034219a | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm034219a | |||||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00109a034 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00109a034 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00109a034 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00109a034 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00109a034 | |||||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
44274207 | 85348 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 501 | 6 | 1 | 4 | 5.7 | Cc1ccc(-c2c(CCC(=O)N3CCC(O)(Cc4ccccc4)CC3)c3cc(Cl)ccc3n2C)cn1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21122 | 85348 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 501 | 6 | 1 | 4 | 5.7 | Cc1ccc(-c2c(CCC(=O)N3CCC(O)(Cc4ccccc4)CC3)c3cc(Cl)ccc3n2C)cn1 | 10.1016/s0960-894x(01)00183-4 | |||
10053419 | 89395 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 555 | 6 | 1 | 4 | 6.4 | Cn1c(-c2ccc(C(F)(F)F)cn2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21792 | 89395 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 555 | 6 | 1 | 4 | 6.4 | Cn1c(-c2ccc(C(F)(F)F)cn2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
44412226 | 175616 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 477 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CCC(=O)N(C)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL437878 | 175616 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 477 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CCC(=O)N(C)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
44433789 | 152912 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391963 | 152912 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44444646 | 100796 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 546 | 5 | 0 | 3 | 5.6 | C[C@@H](O[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N2C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL248748 | 100796 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 546 | 5 | 0 | 3 | 5.6 | C[C@@H](O[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N2C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444693 | 101272 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 516 | 5 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1CN(C2=CC(=O)N(C)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL251557 | 101272 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 516 | 5 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1CN(C2=CC(=O)N(C)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444650 | 161681 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 541 | 5 | 0 | 4 | 6.3 | Cc1cnc(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)cn1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400849 | 161681 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 541 | 5 | 0 | 4 | 6.3 | Cc1cnc(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)cn1 | 10.1016/j.bmcl.2007.06.085 | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00085a015 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00085a015 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00085a015 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00085a015 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00085a015 | |||||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00080a025 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00080a025 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00080a025 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00080a025 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00080a025 | |||||
CHEMBL389652 | 219209 | 0 | None | 2 | 4 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||||
44334114 | 11318 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 562 | 7 | 0 | 4 | 5.9 | CN(C(=O)CN1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1)c1ccccc1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL102382 | 11318 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 562 | 7 | 0 | 4 | 5.9 | CN(C(=O)CN1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1)c1ccccc1 | 10.1016/s0960-894x(01)00616-3 | |||
44295002 | 162741 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 486 | 6 | 0 | 6 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN(Cn3cncn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL406136 | 162741 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 486 | 6 | 0 | 6 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN(Cn3cncn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
44407325 | 80139 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 406 | 6 | 2 | 4 | 4.5 | COc1ccc(OC(F)(F)F)cc1CNC1CCC2CCC1(c1ccccc1)N2 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL201362 | 80139 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 406 | 6 | 2 | 4 | 4.5 | COc1ccc(OC(F)(F)F)cc1CNC1CCC2CCC1(c1ccccc1)N2 | 10.1016/j.bmcl.2005.11.026 | |||
57390403 | 78430 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 503 | 6 | 1 | 7 | 3.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)N(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917861 | 78430 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 503 | 6 | 1 | 7 | 3.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)N(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963614 | 78430 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 503 | 6 | 1 | 7 | 3.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)N(C)C)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
46881728 | 12367 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 628 | 9 | 2 | 6 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3nn[nH]c3CN(C)C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077242 | 12367 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 628 | 9 | 2 | 6 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3nn[nH]c3CN(C)C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46881821 | 12372 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)CC(NCc3ccn[nH]3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077281 | 12372 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)CC(NCc3ccn[nH]3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
46884516 | 14598 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 567 | 5 | 0 | 4 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(C)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089533 | 14598 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 567 | 5 | 0 | 4 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(C)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
42639650 | 194974 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)CCC3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL499004 | 194974 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)CCC3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44444684 | 101059 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 7.0 | CC1=C(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CCC1=O | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL250390 | 101059 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 7.0 | CC1=C(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CCC1=O | 10.1016/j.bmcl.2007.06.085 | |||
44444695 | 101312 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 525 | 5 | 0 | 3 | 7.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC(C)(C)C2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL251768 | 101312 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 525 | 5 | 0 | 3 | 7.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)CC(C)(C)C2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44274251 | 89937 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 535 | 6 | 0 | 4 | 6.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(F)(F)F)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21831 | 89937 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 535 | 6 | 0 | 4 | 6.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(F)(F)F)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
10053174 | 106284 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 545 | 6 | 0 | 4 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL283318 | 106284 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 545 | 6 | 0 | 4 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44412207 | 147110 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 463 | 4 | 1 | 2 | 6.0 | C[C@@H](O[C@H]1CCC(=O)NC[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL380680 | 147110 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 463 | 4 | 1 | 2 | 6.0 | C[C@@H](O[C@H]1CCC(=O)NC[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
9821217 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm980299k | |||
CHEMBL319118 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm980299k | |||
CHEMBL3215877 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm980299k | |||
9821217 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL319118 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL3215877 | 114507 | 21 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2005.11.026 | |||
57403991 | 77734 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3cccc(C)c3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951625 | 77734 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3cccc(C)c3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
44456522 | 165663 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@H]1CN2C(=O)OC[C@@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL409520 | 165663 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@H]1CN2C(=O)OC[C@@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
22885694 | 148225 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 0 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@@H]2CCC(=O)N2C)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL384177 | 148225 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 0 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@@H]2CCC(=O)N2C)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
24888772 | 14788 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccncc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090752 | 14788 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccncc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24752434 | 15905 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1099372 | 15905 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
52947646 | 24017 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256588 | 24017 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52942803 | 24018 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256589 | 24018 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
44444669 | 161194 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 520 | 4 | 1 | 2 | 6.9 | C[C@@H](O[C@@H]1CN(C(=O)NC(C)(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL398919 | 161194 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 520 | 4 | 1 | 2 | 6.9 | C[C@@H](O[C@@H]1CN(C(=O)NC(C)(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
10186401 | 105703 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)cnc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL279442 | 105703 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)cnc21 | 10.1016/s0960-894x(01)00182-2 | |||
24889114 | 14523 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 569 | 5 | 0 | 5 | 6.5 | Cc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089081 | 14523 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 569 | 5 | 0 | 5 | 6.5 | Cc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
46884515 | 14597 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 553 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cn[nH]c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089532 | 14597 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 553 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cn[nH]c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46884472 | 14767 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc[n+]([O-])c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090653 | 14767 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc[n+]([O-])c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24993312 | 186132 | 11 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 475 | 4 | 1 | 2 | 6.7 | C[C@@H](O[C@H]1CC[C@@H]2CNC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL473680 | 186132 | 11 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 475 | 4 | 1 | 2 | 6.7 | C[C@@H](O[C@H]1CC[C@@H]2CNC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44444638 | 162437 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 491 | 5 | 0 | 2 | 6.6 | CC(C)C(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL404855 | 162437 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 491 | 5 | 0 | 2 | 6.6 | CC(C)C(=O)N1C[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1 | 10.1016/j.bmcl.2007.06.085 | |||
3086681 | 9052 | 17 | None | 89125 | 3 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | |||
3510 | 9052 | 17 | None | 89125 | 3 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | |||
CHEMBL42407 | 9052 | 17 | None | 89125 | 3 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1021/jm950616c | |||
44333730 | 114449 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 561 | 7 | 0 | 3 | 7.5 | CCC(=O)N(c1ccccc1)C1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL319046 | 114449 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 561 | 7 | 0 | 3 | 7.5 | CCC(=O)N(c1ccccc1)C1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
10098209 | 105865 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL280662 | 105865 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
57400915 | 78393 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 4.1 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917844 | 78393 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 4.1 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963412 | 78393 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 4.1 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(C(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
44416078 | 146916 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 544 | 8 | 1 | 4 | 6.9 | CCN(Cc1nc[nH]n1)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL380210 | 146916 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 544 | 8 | 1 | 4 | 6.9 | CCN(Cc1nc[nH]n1)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
16006943 | 148222 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 530 | 7 | 1 | 4 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2nc[nH]n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL384171 | 148222 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 530 | 7 | 1 | 4 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2nc[nH]n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
46884473 | 14561 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.6 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cncnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089397 | 14561 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.6 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cncnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46883823 | 15204 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 586 | 5 | 1 | 4 | 6.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(N3CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093596 | 15204 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 586 | 5 | 1 | 4 | 6.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(N3CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52948931 | 24021 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256592 | 24021 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
44444660 | 161425 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 516 | 4 | 0 | 3 | 5.7 | C[C@@H](O[C@@H]1CN(C(=O)N2CCOCC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL399466 | 161425 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 516 | 4 | 0 | 3 | 5.7 | C[C@@H](O[C@@H]1CN(C(=O)N2CCOCC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444685 | 161551 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)=CC1=O | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400148 | 161551 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 515 | 5 | 0 | 3 | 6.9 | CC1CC(N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)=CC1=O | 10.1016/j.bmcl.2007.06.085 | |||
44444692 | 162253 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 503 | 5 | 0 | 4 | 5.9 | C[C@@H](O[C@@H]1CN(C2=CC(=O)OC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL404001 | 162253 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 503 | 5 | 0 | 4 | 5.9 | C[C@@H](O[C@@H]1CN(C2=CC(=O)OC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44593632 | 185548 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 420 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)OC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL468830 | 185548 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 420 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)OC2 | 10.1016/j.bmc.2008.06.047 | |||
44177570 | 68034 | 0 | None | 15 | 4 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766204 | 68034 | 0 | None | 15 | 4 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
10460917 | 170528 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL420543 | 170528 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9700171 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9700171 | |||
73352606 | 99748 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 323 | 5 | 0 | 3 | 4.0 | COc1ccccc1CO[C@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2441368 | 99748 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 323 | 5 | 0 | 3 | 4.0 | COc1ccccc1CO[C@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
10460917 | 170528 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL420543 | 170528 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
57402689 | 75397 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.3 | CCNC(=O)N1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917845 | 75397 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.3 | CCNC(=O)N1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
23146876 | 77732 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 595 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CCC(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=C(c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951623 | 77732 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 595 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CCC(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=C(c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
44433802 | 153569 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392464 | 153569 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44433804 | 153573 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392466 | 153573 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
22885615 | 86955 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 550 | 10 | 1 | 4 | 5.7 | COCCN(CC(N)=O)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL213538 | 86955 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 550 | 10 | 1 | 4 | 5.7 | COCCN(CC(N)=O)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
52947645 | 24015 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256586 | 24015 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52947647 | 24019 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256590 | 24019 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
44233185 | 201601 | 0 | None | 47 | 4 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL539193 | 201601 | 0 | None | 47 | 4 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
57397021 | 77733 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(C)cc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951624 | 77733 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 611 | 5 | 0 | 3 | 5.9 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(C)cc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
46884471 | 14521 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cccnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089062 | 14521 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cccnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24768572 | 14541 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 624 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089270 | 14541 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 624 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24888942 | 14718 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 7.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090437 | 14718 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 7.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46883824 | 15205 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093597 | 15205 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44444640 | 100755 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.8 | C[C@@H](O[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL248545 | 100755 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.8 | C[C@@H](O[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444694 | 161604 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 525 | 5 | 0 | 3 | 7.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(C)(C)CC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400393 | 161604 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 525 | 5 | 0 | 3 | 7.5 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(C)(C)CC2)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
9850771 | 126656 | 3 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL348976 | 126656 | 3 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
15253734 | 172128 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 563 | 10 | 2 | 4 | 4.8 | CC(=O)N(Cc1ccccc1Cl)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1 | 10.1021/jm950616c | |||
CHEMBL423623 | 172128 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 563 | 10 | 2 | 4 | 4.8 | CC(=O)N(Cc1ccccc1Cl)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1 | 10.1021/jm950616c | |||
46227362 | 209363 | 0 | None | 12 | 4 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611926 | 209363 | 0 | None | 12 | 4 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
44274166 | 87026 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 528 | 7 | 1 | 4 | 6.2 | CC(=O)c1ccc2c(c1)c(CCC(=O)N1CCC(O)(Cc3ccccc3)CC1)c(-c1ccc(Cl)cc1)n2C | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21385 | 87026 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 528 | 7 | 1 | 4 | 6.2 | CC(=O)c1ccc2c(c1)c(CCC(=O)N1CCC(O)(Cc3ccccc3)CC1)c(-c1ccc(Cl)cc1)n2C | 10.1016/s0960-894x(01)00182-2 | |||
44412236 | 84914 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 503 | 4 | 1 | 5 | 6.0 | C[C@@H](O[C@H]1CCc2nnc(O)n2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL210365 | 84914 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 503 | 4 | 1 | 5 | 6.0 | C[C@@H](O[C@H]1CCc2nnc(O)n2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
22885699 | 87795 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 506 | 7 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(N)=O)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL215373 | 87795 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 506 | 7 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(N)=O)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
22885703 | 148204 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 520 | 7 | 1 | 3 | 5.9 | CNC(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL384112 | 148204 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 520 | 7 | 1 | 3 | 5.9 | CNC(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
44357006 | 20497 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 575 | 8 | 1 | 6 | 5.7 | C[C@@H](OC1OCCN(Cc2n[nH]nc2CN(C)C)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
CHEMBL1195055 | 20497 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 575 | 8 | 1 | 6 | 5.7 | C[C@@H](OC1OCCN(Cc2n[nH]nc2CN(C)C)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
CHEMBL553778 | 20497 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 575 | 8 | 1 | 6 | 5.7 | C[C@@H](OC1OCCN(Cc2n[nH]nc2CN(C)C)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
44356378 | 32514 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 587 | 8 | 1 | 6 | 5.9 | C[C@@H](OC1OCCN(Cc2n[nH]nc2CN2CCC2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
CHEMBL135263 | 32514 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 587 | 8 | 1 | 6 | 5.9 | C[C@@H](OC1OCCN(Cc2n[nH]nc2CN2CCC2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
10480465 | 215194 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL99792 | 215194 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
24785717 | 128883 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 464 | 6 | 0 | 3 | 6.4 | CN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596492 | 128883 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 464 | 6 | 0 | 3 | 6.4 | CN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
18669097 | 106178 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 495 | 7 | 1 | 3 | 6.6 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)C)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL282725 | 106178 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 495 | 7 | 1 | 3 | 6.6 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)C)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
57402692 | 78385 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917869 | 78385 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963302 | 78385 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 8 | 2 | 8 | 2.3 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@@H]1CCN(C(=O)CNC(C)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
57402221 | 77798 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.8 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951814 | 77798 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 4.8 | Cc1cc(F)ccc1[C@H]1CN(C(=O)C(N)=O)CC[C@@H]1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.11.048 | |||
22885697 | 148450 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 546 | 7 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL385463 | 148450 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 546 | 7 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
44433394 | 153436 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL392368 | 153436 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 406 | 6 | 2 | 3 | 5.1 | COc1ccc(C(C)(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00016a014 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00016a014 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00016a014 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
10553959 | 194649 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL49638 | 194649 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00066a015 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00066a015 | |||
9796216 | 109020 | 15 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@@H]1CCCN[C@@H]1c1ccccc1 | 10.1016/S0960-894X(01)81021-0 | |||
CHEMBL303118 | 109020 | 15 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@@H]1CCCN[C@@H]1c1ccccc1 | 10.1016/S0960-894X(01)81021-0 | |||
44294293 | 195232 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 429 | 4 | 0 | 2 | 6.1 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL50270 | 195232 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 429 | 4 | 0 | 2 | 6.1 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
10098209 | 105865 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL280662 | 105865 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
57402265 | 77737 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 639 | 6 | 0 | 3 | 6.7 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccccc3C(C)C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951628 | 77737 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 639 | 6 | 0 | 3 | 6.7 | CC(=O)N1CCC(C(=O)N2CC[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccccc3C(C)C)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
44433797 | 152914 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391964 | 152914 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 615 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
52948868 | 24020 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256591 | 24020 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
46883879 | 14542 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 626 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089271 | 14542 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 626 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44593636 | 188399 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 432 | 5 | 2 | 3 | 5.4 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL477365 | 188399 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 432 | 5 | 2 | 3 | 5.4 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
11814040 | 85584 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 601 | 8 | 1 | 6 | 6.3 | C[C@@H](O[C@H]1OCCN(Cc2nn[nH]c2CN2CCCC2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
CHEMBL2112743 | 85584 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 601 | 8 | 1 | 6 | 6.3 | C[C@@H](O[C@H]1OCCN(Cc2nn[nH]c2CN2CCCC2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
9871891 | 12231 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 537 | 4 | 0 | 4 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL107482 | 12231 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 537 | 4 | 0 | 4 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
9871891 | 12231 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 537 | 4 | 0 | 4 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm0311487 | |||
CHEMBL107482 | 12231 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 537 | 4 | 0 | 4 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm0311487 | |||
11318556 | 100710 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | CN(C)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL24829 | 100710 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | CN(C)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
9871414 | 105773 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ncc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL279977 | 105773 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ncc21 | 10.1016/s0960-894x(01)00182-2 | |||
44274253 | 179056 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 564 | 6 | 1 | 3 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Br)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL447473 | 179056 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 564 | 6 | 1 | 3 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Br)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
10099787 | 110289 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.4 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CCCO3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085129 | 110289 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.4 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CCCO3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
10480465 | 215194 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL99792 | 215194 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 5.8 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nc[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
44412245 | 84732 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 503 | 4 | 1 | 5 | 6.0 | C[C@@H](O[C@H]1CCn2c(O)nnc2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL209657 | 84732 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 503 | 4 | 1 | 5 | 6.0 | C[C@@H](O[C@H]1CCn2c(O)nnc2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
44444689 | 101000 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.6 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(O)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249938 | 101000 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.6 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(O)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
24755076 | 98358 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 408 | 6 | 2 | 5 | 3.4 | COc1ccc(OC(F)(F)F)cc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2COC[C@@H]12 | 10.1016/j.bmcl.2007.10.010 | |||
CHEMBL240706 | 98358 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 408 | 6 | 2 | 5 | 3.4 | COc1ccc(OC(F)(F)F)cc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2COC[C@@H]12 | 10.1016/j.bmcl.2007.10.010 | |||
44412445 | 84694 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.2 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CNC1=O | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL209456 | 84694 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.2 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CNC1=O | 10.1016/j.bmcl.2006.02.080 | |||
135405092 | 146061 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 546 | 7 | 2 | 5 | 6.2 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2n[nH]c(O)n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL379137 | 146061 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 546 | 7 | 2 | 5 | 6.2 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2n[nH]c(O)n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
3086681 | 9052 | 17 | None | 89125 | 3 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1016/s0960-894x(01)00250-5 | |||
3510 | 9052 | 17 | None | 89125 | 3 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42407 | 9052 | 17 | None | 89125 | 3 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 10.1016/s0960-894x(01)00250-5 | |||
10257218 | 31611 | 3 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL134500 | 31611 | 3 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
10460917 | 170528 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL420543 | 170528 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
10101238 | 41616 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 528 | 7 | 0 | 3 | 5.9 | O=C(CN1CCCC1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL143156 | 41616 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 528 | 7 | 0 | 3 | 5.9 | O=C(CN1CCCC1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.bmc.2013.03.016 | |||||
44407370 | 81226 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 619 | 11 | 3 | 6 | 5.4 | O=S(=O)(NCC1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1)c1ccccc1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL202775 | 81226 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 619 | 11 | 3 | 6 | 5.4 | O=S(=O)(NCC1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1)c1ccccc1 | 10.1016/j.bmcl.2005.11.026 | |||
22885698 | 146123 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 520 | 8 | 1 | 3 | 6.1 | CCN(CC(N)=O)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL379289 | 146123 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 520 | 8 | 1 | 3 | 6.1 | CCN(CC(N)=O)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
44444629 | 100874 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 449 | 5 | 0 | 2 | 5.6 | C[C@@H](O[C@@H]1CN(C=O)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249143 | 100874 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 449 | 5 | 0 | 2 | 5.6 | C[C@@H](O[C@@H]1CN(C=O)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmc.2013.09.001 | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmc.2013.09.001 | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmc.2013.09.001 | |||
58993578 | 128884 | 0 | None | - | 0 | Mongolian jird | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 478 | 7 | 0 | 3 | 6.8 | CCN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596493 | 128884 | 0 | None | - | 0 | Mongolian jird | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 478 | 7 | 0 | 3 | 6.8 | CCN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
9891865 | 86832 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 493 | 8 | 1 | 3 | 6.5 | COCCN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL212991 | 86832 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 493 | 8 | 1 | 3 | 6.5 | COCCN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
22885692 | 86953 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 449 | 5 | 1 | 2 | 6.5 | CN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL213515 | 86953 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 449 | 5 | 1 | 2 | 6.5 | CN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
44415869 | 87468 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 546 | 7 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL215147 | 87468 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 546 | 7 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CC[C@@H](N(C)C[C@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
22885691 | 88091 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 463 | 6 | 1 | 2 | 6.9 | CCN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL215889 | 88091 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 463 | 6 | 1 | 2 | 6.9 | CCN[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
10951720 | 85582 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 547 | 7 | 2 | 6 | 5.1 | C[C@@H](O[C@H]1OCCN(Cc2nn[nH]c2CN)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
CHEMBL2112741 | 85582 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 547 | 7 | 2 | 6 | 5.1 | C[C@@H](O[C@H]1OCCN(Cc2nn[nH]c2CN)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0109558 | |||
10369373 | 168739 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 519 | 4 | 0 | 4 | 5.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL415705 | 168739 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 519 | 4 | 0 | 4 | 5.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
24992986 | 191083 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 489 | 4 | 0 | 2 | 7.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL484133 | 191083 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 489 | 4 | 0 | 2 | 7.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44294659 | 110291 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 624 | 6 | 1 | 3 | 8.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N2CCC(C3CCOC3(C)C)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085131 | 110291 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 624 | 6 | 1 | 3 | 8.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N2CCC(C3CCOC3(C)C)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
9869697 | 71415 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 478 | 8 | 1 | 5 | 4.3 | COc1ccc(NS(C)(=O)=O)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817895 | 71415 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 478 | 8 | 1 | 5 | 4.3 | COc1ccc(NS(C)(=O)=O)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
10341570 | 127852 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL357012 | 127852 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
44274153 | 84655 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 512 | 7 | 1 | 3 | 6.7 | C=Cc1ccc2c(c1)c(CCC(=O)N1CCC(O)(Cc3ccccc3)CC1)c(-c1ccc(Cl)cc1)n2C | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL20937 | 84655 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 512 | 7 | 1 | 3 | 6.7 | C=Cc1ccc2c(c1)c(CCC(=O)N1CCC(O)(Cc3ccccc3)CC1)c(-c1ccc(Cl)cc1)n2C | 10.1016/s0960-894x(01)00182-2 | |||
135529973 | 128288 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 448 | 6 | 2 | 6 | 4.2 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
CHEMBL358343 | 128288 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 448 | 6 | 2 | 6 | 4.2 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(O)n2)[C@H]1c1ccccc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
44407459 | 147889 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 633 | 10 | 3 | 7 | 4.9 | O=C(NS(=O)(=O)c1ccccc1)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL382720 | 147889 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 633 | 10 | 3 | 7 | 4.9 | O=C(NS(=O)(=O)c1ccccc1)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
44456524 | 104714 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@H]1CN2C(=O)OC[C@@H]2[C@@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL272569 | 104714 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@H]1CN2C(=O)OC[C@@H]2[C@@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
44416008 | 87277 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 557 | 7 | 1 | 3 | 6.7 | C[C@@H](O[C@H]1CC[C@@H](N(C)C(=O)Cc2c[nH]cn2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL214748 | 87277 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 557 | 7 | 1 | 3 | 6.7 | C[C@@H](O[C@H]1CC[C@@H](N(C)C(=O)Cc2c[nH]cn2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
46884470 | 14766 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 580 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[nH]c(=O)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090652 | 14766 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 580 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[nH]c(=O)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
18407037 | 169038 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 521 | 6 | 0 | 4 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL416372 | 169038 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 521 | 6 | 0 | 4 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
18407037 | 169038 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 521 | 6 | 0 | 4 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL416372 | 169038 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 521 | 6 | 0 | 4 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44412173 | 85016 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 486 | 4 | 0 | 3 | 6.9 | C[C@@H](O[C@H]1CCc2nccn2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL210630 | 85016 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 486 | 4 | 0 | 3 | 6.9 | C[C@@H](O[C@H]1CCc2nccn2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
44456700 | 102684 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CO)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL259251 | 102684 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CO)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
44415789 | 148443 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 564 | 9 | 1 | 4 | 5.6 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N(C)CCO)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL385414 | 148443 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 564 | 9 | 1 | 4 | 5.6 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N(C)CCO)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
10144275 | 25665 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.7 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)C[C@@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL128369 | 25665 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.7 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)C[C@@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
22293490 | 108087 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 636 | 7 | 2 | 3 | 7.8 | O=C(NC(CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL296583 | 108087 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 636 | 7 | 2 | 3 | 7.8 | O=C(NC(CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
24785717 | 128883 | 0 | None | - | 0 | Mongolian jird | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 464 | 6 | 0 | 3 | 6.4 | CN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596492 | 128883 | 0 | None | - | 0 | Mongolian jird | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 464 | 6 | 0 | 3 | 6.4 | CN1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
44356404 | 29980 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 561 | 8 | 2 | 6 | 5.4 | CNCc1n[nH]nc1CN1CCOC(O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccc(F)cc1 | 10.1021/jm0109558 | |||
CHEMBL133140 | 29980 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 561 | 8 | 2 | 6 | 5.4 | CNCc1n[nH]nc1CN1CCOC(O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccc(F)cc1 | 10.1021/jm0109558 | |||
18669091 | 11457 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 505 | 6 | 0 | 3 | 6.4 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL103367 | 11457 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 505 | 6 | 0 | 3 | 6.4 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
10008129 | 67852 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 567 | 11 | 2 | 3 | 6.3 | O=C(CCCN1CCCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL176500 | 67852 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 567 | 11 | 2 | 3 | 6.3 | O=C(CCCN1CCCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
9938284 | 108192 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 584 | 5 | 1 | 4 | 6.6 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CC2)OCCO3)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL297344 | 108192 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 584 | 5 | 1 | 4 | 6.6 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CC2)OCCO3)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
11755227 | 209855 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 488 | 6 | 0 | 3 | 5.5 | CN(C)C(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL63793 | 209855 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 488 | 6 | 0 | 3 | 5.5 | CN(C)C(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
71450870 | 85434 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 407 | 4 | 1 | 4 | 5.0 | COc1ccc(OC(F)(F)F)cc1[C@H]1COC2(CCCN[C@H]2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL2112368 | 85434 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 407 | 4 | 1 | 4 | 5.0 | COc1ccc(OC(F)(F)F)cc1[C@H]1COC2(CCCN[C@H]2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
22885695 | 145902 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 564 | 10 | 1 | 4 | 6.0 | COCCNC(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL378689 | 145902 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 564 | 10 | 1 | 4 | 6.0 | COCCNC(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
46881600 | 13878 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 493 | 5 | 1 | 3 | 5.3 | CC(=O)N1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)[C@@H]1CO | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1085196 | 13878 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 493 | 5 | 1 | 3 | 5.3 | CC(=O)N1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)[C@@H]1CO | 10.1016/j.bmcl.2010.01.065 | |||
44444689 | 101000 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.6 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(O)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249938 | 101000 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.6 | C[C@@H](O[C@@H]1CN(C2=CC(=O)C(O)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44444671 | 161535 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 575 | 4 | 0 | 3 | 5.7 | CC(=O)N1CCN(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL400060 | 161535 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 575 | 4 | 0 | 3 | 5.7 | CC(=O)N1CCN(C(=O)N2C[C@@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1 | 10.1016/j.bmcl.2007.06.085 | |||
57402688 | 78381 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 438 | 6 | 1 | 5 | 4.3 | COC(=O)N1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917843 | 78381 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 438 | 6 | 1 | 5 | 4.3 | COC(=O)N1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963298 | 78381 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 438 | 6 | 1 | 5 | 4.3 | COC(=O)N1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
52941489 | 24503 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258623 | 24503 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
10768417 | 172381 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 525 | 7 | 0 | 4 | 5.7 | O=C(Cn1ccnc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL424291 | 172381 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 525 | 7 | 0 | 4 | 5.7 | O=C(Cn1ccnc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.ejmech.2013.01.044 | |||||
58993533 | 128876 | 0 | None | - | 0 | Mongolian jird | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 486 | 6 | 1 | 3 | 6.4 | N#Cc1c(F)cc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596485 | 128876 | 0 | None | - | 0 | Mongolian jird | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 486 | 6 | 1 | 3 | 6.4 | N#Cc1c(F)cc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
19797422 | 103438 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 523 | 6 | 0 | 2 | 6.4 | Cc1cc(I)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL263795 | 103438 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 523 | 6 | 0 | 2 | 6.4 | Cc1cc(I)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
10346229 | 89797 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 509 | 7 | 0 | 4 | 6.6 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)C)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21813 | 89797 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 509 | 7 | 0 | 4 | 6.6 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)C)cc3)n(C)c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
21955317 | 110290 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 632 | 7 | 2 | 3 | 7.9 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(O)(Cc3ccccc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085130 | 110290 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 632 | 7 | 2 | 3 | 7.9 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(O)(Cc3ccccc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
44412374 | 84569 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.7 | C[C@H]1[C@H](c2ccc(F)cc2)[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCC(=O)N1C | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL209240 | 84569 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.7 | C[C@H]1[C@H](c2ccc(F)cc2)[C@@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCC(=O)N1C | 10.1016/j.bmcl.2006.02.080 | |||
11678857 | 146085 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 608 | 4 | 0 | 3 | 7.6 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL379224 | 146085 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 608 | 4 | 0 | 3 | 7.6 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
44456865 | 104679 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN2C(=O)OC[C@@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL272469 | 104679 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN2C(=O)OC[C@@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
14986135 | 170180 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm058225d | |||
CHEMBL419500 | 170180 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm058225d | |||
44334275 | 11844 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 485 | 7 | 0 | 3 | 6.3 | CC(C)CCN1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL105420 | 11844 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 485 | 7 | 0 | 3 | 6.3 | CC(C)CCN1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
10415870 | 110287 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.3 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CCOC3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085127 | 110287 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.3 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CCOC3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
10483816 | 197977 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL51893 | 197977 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00250-0 | |||
10483816 | 86405 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115007 | 86405 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
10415870 | 147387 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL381390 | 147387 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 582 | 5 | 1 | 3 | 7.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
53379508 | 73235 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 469 | 7 | 0 | 4 | 5.8 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817891 | 73235 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 469 | 7 | 0 | 4 | 5.8 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852123 | 73235 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 469 | 7 | 0 | 4 | 5.8 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
22885696 | 145706 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 532 | 7 | 2 | 3 | 6.1 | C[C@@H](O[C@H]1CC[C@@H](NC[C@@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL378416 | 145706 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 532 | 7 | 2 | 3 | 6.1 | C[C@@H](O[C@H]1CC[C@@H](NC[C@@H]2CCC(=O)N2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
44444654 | 100832 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 534 | 5 | 1 | 4 | 5.0 | C[C@@H](O[C@@H]1CN(C(=O)[C@@H]2COC(=O)N2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL248943 | 100832 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 534 | 5 | 1 | 4 | 5.0 | C[C@@H](O[C@@H]1CN(C(=O)[C@@H]2COC(=O)N2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
15516313 | 185496 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 434 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)[C@@](C)(C(F)(F)F)OCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL468350 | 185496 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 434 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)[C@@](C)(C(F)(F)F)OCC2 | 10.1016/j.bmc.2008.06.047 | |||
44593636 | 188399 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 432 | 5 | 2 | 3 | 5.4 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL477365 | 188399 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 432 | 5 | 2 | 3 | 5.4 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C)(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
10698096 | 62647 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL162337 | 62647 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
44334149 | 11371 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 497 | 5 | 0 | 3 | 6.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(C3CCCCC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL102730 | 11371 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 497 | 5 | 0 | 3 | 6.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(C3CCCCC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
10393962 | 110292 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 610 | 5 | 1 | 3 | 8.2 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CC2)CCC(C)(C)O3)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085132 | 110292 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 610 | 5 | 1 | 3 | 8.2 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC3(CC2)CCC(C)(C)O3)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
22293475 | 193907 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL49176 | 193907 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
18782542 | 118242 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 405 | 4 | 1 | 4 | 4.9 | COc1ccc(OC(F)(F)F)cc1C1=CC2(CCCNC2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL327606 | 118242 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 405 | 4 | 1 | 4 | 4.9 | COc1ccc(OC(F)(F)F)cc1C1=CC2(CCCNC2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
11146618 | 85583 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 631 | 10 | 1 | 6 | 7.3 | CC(C)N(Cc1[nH]nnc1CN1CCO[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccc(F)cc1)C(C)C | 10.1021/jm0109558 | |||
CHEMBL2112742 | 85583 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 631 | 10 | 1 | 6 | 7.3 | CC(C)N(Cc1[nH]nnc1CN1CCO[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccc(F)cc1)C(C)C | 10.1021/jm0109558 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
44346234 | 21419 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CCN2CCC[C@H]1[C@@H]2c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL120523 | 21419 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CCN2CCC[C@H]1[C@@H]2c1ccccc1 | 10.1021/jm9700171 | |||
10415534 | 172985 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 567 | 10 | 3 | 3 | 6.2 | O=C(CCC1CCNCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL426577 | 172985 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 567 | 10 | 3 | 3 | 6.2 | O=C(CCC1CCNCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
22885704 | 88300 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 576 | 7 | 0 | 4 | 6.0 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCOCC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL216018 | 88300 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 576 | 7 | 0 | 4 | 6.0 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCOCC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44444659 | 100947 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@@H]1CN(C(=O)N(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL249568 | 100947 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@@H]1CN(C(=O)N(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
9855000 | 27393 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL130834 | 27393 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
18669080 | 11780 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 519 | 6 | 0 | 3 | 6.0 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(Cc3ccccc3)C(=O)C2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL105047 | 11780 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 519 | 6 | 0 | 3 | 6.0 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(Cc3ccccc3)C(=O)C2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
10210026 | 108137 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 569 | 6 | 1 | 3 | 6.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCN(C(C)C)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL296979 | 108137 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 569 | 6 | 1 | 3 | 6.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCN(C(C)C)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
58993465 | 128885 | 0 | None | - | 0 | Mongolian jird | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 7 | 0 | 3 | 7.2 | CC(C)N1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596494 | 128885 | 0 | None | - | 0 | Mongolian jird | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 7 | 0 | 3 | 7.2 | CC(C)N1CCC(COCc2cc(-c3ccc(C#N)cc3)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2015.04.098 | |||
22885702 | 87282 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 534 | 7 | 0 | 3 | 6.3 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N(C)C)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL214761 | 87282 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 534 | 7 | 0 | 3 | 6.3 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N(C)C)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
46884434 | 14697 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 593 | 6 | 1 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(CO)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090288 | 14697 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 593 | 6 | 1 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(CO)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44346438 | 121528 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 564 | 8 | 0 | 3 | 7.1 | CN(Cc1ccccc1)C(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL333882 | 121528 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 564 | 8 | 0 | 3 | 7.1 | CN(Cc1ccccc1)C(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9700171 | |||
10098987 | 66755 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173396 | 66755 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00035a006 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950654w | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950654w | |||
44410317 | 83925 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 543 | 5 | 1 | 6 | 5.6 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2(F)c1nnn(C)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL207794 | 83925 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 543 | 5 | 1 | 6 | 5.6 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2(F)c1nnn(C)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
44415921 | 148525 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 7 | 2 | 3 | 5.3 | C[C@@H](O[C@H]1CC[C@@H](NCC(N)=O)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL385925 | 148525 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 492 | 7 | 2 | 3 | 5.3 | C[C@@H](O[C@H]1CC[C@@H](NCC(N)=O)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
24889458 | 15202 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 583 | 6 | 0 | 5 | 6.7 | CCc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093594 | 15202 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 583 | 6 | 0 | 5 | 6.7 | CCc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
9821217 | 114507 | 21 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL319118 | 114507 | 21 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL3215877 | 114507 | 21 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 4.2 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
44593633 | 189221 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 404 | 5 | 2 | 3 | 4.9 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL478620 | 189221 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 404 | 5 | 2 | 3 | 4.9 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CC2 | 10.1016/j.bmc.2008.06.047 | |||
44577989 | 196209 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 392 | 6 | 2 | 3 | 4.9 | COc1ccc(C(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL513351 | 196209 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 392 | 6 | 2 | 3 | 4.9 | COc1ccc(C(C)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
9984665 | 12114 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 536 | 4 | 0 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL106864 | 12114 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 536 | 4 | 0 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
104943 | 62160 | 39 | None | - | 3 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL16192 | 62160 | 39 | None | - | 3 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm070577s | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm070577s | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm070577s | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm070577s | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm070577s | |||||
44412493 | 84669 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CC(=O)N1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL209407 | 84669 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 477 | 4 | 1 | 2 | 6.4 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CC(=O)N1 | 10.1016/j.bmcl.2006.02.080 | |||
44415909 | 86661 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 7 | 2 | 4 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2c[nH]c(O)n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL212349 | 86661 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 545 | 7 | 2 | 4 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)Cc2c[nH]c(O)n2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
49863732 | 22103 | 0 | None | 24 | 4 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
CHEMBL1214025 | 22103 | 0 | None | 24 | 4 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
135430679 | 52819 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 408 | 8 | 2 | 5 | 4.5 | Cc1cc(COC[C@H](c2ccccc2)N(C)Cc2n[nH]c(O)n2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL153310 | 52819 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 408 | 8 | 2 | 5 | 4.5 | Cc1cc(COC[C@H](c2ccccc2)N(C)Cc2n[nH]c(O)n2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(97)10163-9 | |||
44294660 | 110293 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 610 | 6 | 1 | 4 | 7.1 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(C3CCOC3=O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085133 | 110293 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 610 | 6 | 1 | 4 | 7.1 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(C3CCOC3=O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
53379509 | 73230 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 6.0 | COc1ccc(C(C)C)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817892 | 73230 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 6.0 | COc1ccc(C(C)C)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852099 | 73230 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 6.0 | COc1ccc(C(C)C)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
44433789 | 152912 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391963 | 152912 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
24750888 | 15223 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 504 | 4 | 1 | 3 | 5.4 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093751 | 15223 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 504 | 4 | 1 | 3 | 5.4 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
135430775 | 52119 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 474 | 8 | 2 | 5 | 4.9 | CN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL152685 | 52119 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 474 | 8 | 2 | 5 | 4.9 | CN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
44412235 | 146953 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 486 | 4 | 0 | 3 | 6.9 | C[C@@H](O[C@H]1CCn2ccnc2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL380388 | 146953 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 486 | 4 | 0 | 3 | 6.9 | C[C@@H](O[C@H]1CCn2ccnc2C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
44415808 | 88236 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 560 | 7 | 0 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCCC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL215975 | 88236 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 560 | 7 | 0 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCCC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
11756257 | 174562 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 515 | 12 | 3 | 5 | 3.8 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(CO)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL43044 | 174562 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 515 | 12 | 3 | 5 | 3.8 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(CO)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
18669059 | 105546 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 521 | 6 | 1 | 3 | 6.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(F)(F)F)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL278149 | 105546 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 521 | 6 | 1 | 3 | 6.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(F)(F)F)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44412373 | 145878 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.6 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CN(C)C1=O | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL378663 | 145878 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.6 | C[C@@H]1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)CN(C)C1=O | 10.1016/j.bmcl.2006.02.080 | |||
21955285 | 195773 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 636 | 7 | 2 | 3 | 7.8 | O=C(N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)C(CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL50867 | 195773 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 636 | 7 | 2 | 3 | 7.8 | O=C(N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)C(CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
24785978 | 128874 | 0 | None | - | 0 | Mongolian jird | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596483 | 128874 | 0 | None | - | 0 | Mongolian jird | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
9329 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1016/j.bmc.2011.07.014 | |||
9894349 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL339486 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1016/j.bmc.2011.07.014 | |||
9329 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
9894349 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
CHEMBL339486 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
10392469 | 201634 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL539928 | 201634 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
44177669 | 68035 | 0 | None | 2 | 4 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766205 | 68035 | 0 | None | 2 | 4 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
10325507 | 67216 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 561 | 10 | 2 | 3 | 6.5 | O=C(CCc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL175224 | 67216 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 561 | 10 | 2 | 3 | 6.5 | O=C(CCc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
44444674 | 101100 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 639 | 4 | 0 | 5 | 6.7 | C[C@@H](O[C@@H]1CN(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL250596 | 101100 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 639 | 4 | 0 | 5 | 6.7 | C[C@@H](O[C@@H]1CN(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44408291 | 147658 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 677 | 5 | 0 | 3 | 8.1 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCN(c4ccccc4Cl)C(=O)C3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL381984 | 147658 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 677 | 5 | 0 | 3 | 8.1 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCN(c4ccccc4Cl)C(=O)C3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
44408177 | 147753 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 624 | 5 | 0 | 4 | 7.1 | COC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL382331 | 147753 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 624 | 5 | 0 | 4 | 7.1 | COC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
44408290 | 148027 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 7.4 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCN(c4ccccc4)C(=O)C3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL383048 | 148027 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 7.4 | CC1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN([C@]2(c3ccccc3)CC[C@@H](N3CCN(c4ccccc4)C(=O)C3)CC2)C1=O | 10.1016/j.bmcl.2005.11.111 | |||
10007758 | 185760 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 551 | 12 | 2 | 6 | 4.5 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-n2ccnc2)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL47070 | 185760 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 551 | 12 | 2 | 6 | 4.5 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-n2ccnc2)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
46227363 | 206444 | 0 | None | 28 | 4 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL592969 | 206444 | 0 | None | 28 | 4 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
44412453 | 168468 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.7 | C[C@@H](O[C@H]1C[C@@H](C)N(C)C(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL413279 | 168468 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 491 | 4 | 0 | 2 | 6.7 | C[C@@H](O[C@H]1C[C@@H](C)N(C)C(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
21955222 | 108560 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 634 | 6 | 1 | 2 | 9.0 | CC(C)(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL300014 | 108560 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 634 | 6 | 1 | 2 | 9.0 | CC(C)(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
10392469 | 201634 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm501535r | |||
CHEMBL539928 | 201634 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm501535r | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00006a012 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00006a012 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00006a012 | |||
10098987 | 66755 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173396 | 66755 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
10720240 | 41870 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 502 | 7 | 0 | 3 | 5.4 | CN(C)CC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL143375 | 41870 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 502 | 7 | 0 | 3 | 5.4 | CN(C)CC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80534-5 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9506534 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9506534 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm9506534 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm950654w | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm950654w | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm950654w | |||
105083 | 32223 | 3 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CNC1CCCN[C@H]1c1ccccc1 | 10.1021/jm980299k | |||
CHEMBL135022 | 32223 | 3 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CNC1CCCN[C@H]1c1ccccc1 | 10.1021/jm980299k | |||
44410278 | 147642 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 525 | 5 | 1 | 6 | 5.5 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2c1nnn(C)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL381965 | 147642 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 525 | 5 | 1 | 6 | 5.5 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2c1nnn(C)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
44408176 | 81098 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 594 | 4 | 0 | 3 | 7.4 | O=C1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN1[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL202439 | 81098 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 594 | 4 | 0 | 3 | 7.4 | O=C1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN1[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80349-2 | |||
44593634 | 189568 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 418 | 5 | 2 | 3 | 5.3 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL479049 | 189568 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 418 | 5 | 2 | 3 | 5.3 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CCC2 | 10.1016/j.bmc.2008.06.047 | |||
10099939 | 11759 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL104954 | 11759 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
9830304 | 114124 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 608 | 7 | 2 | 4 | 5.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cn(C)c2ccccc12 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL317632 | 114124 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 608 | 7 | 2 | 4 | 5.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cn(C)c2ccccc12 | 10.1016/s0960-894x(01)00631-x | |||
10099939 | 11759 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
CHEMBL104954 | 11759 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80747-2 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00080-D | |||
10814682 | 214493 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ncc[nH]3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL95626 | 214493 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ncc[nH]3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44433798 | 152464 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391615 | 152464 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
46884468 | 14764 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 578 | 5 | 0 | 3 | 7.5 | Cc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090650 | 14764 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 578 | 5 | 0 | 3 | 7.5 | Cc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
44415896 | 145692 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 507 | 8 | 0 | 3 | 6.8 | COCCN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL378331 | 145692 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 507 | 8 | 0 | 3 | 6.8 | COCCN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
44299271 | 202827 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL56038 | 202827 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
42639649 | 177524 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 553 | 5 | 0 | 4 | 7.4 | C[C@@H](O[C@H]1CC[C@@H]2CN(c3cnccn3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL445239 | 177524 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 553 | 5 | 0 | 4 | 7.4 | C[C@@H](O[C@H]1CC[C@@H]2CN(c3cnccn3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44334107 | 11177 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 532 | 6 | 0 | 3 | 7.2 | CC(=O)C1(c2ccccc2)CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL101421 | 11177 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 532 | 6 | 0 | 3 | 7.2 | CC(=O)C1(c2ccccc2)CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
44299271 | 202827 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56038 | 202827 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
10814682 | 214493 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ncc[nH]3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL95626 | 214493 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ncc[nH]3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
44412159 | 147699 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 477 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CCN(C)C(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL382255 | 147699 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 477 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CCN(C)C(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
46884430 | 15092 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CN2C(=O)C=CCC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1092755 | 15092 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 487 | 4 | 0 | 2 | 6.3 | C[C@@H](O[C@H]1CN2C(=O)C=CCC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
22901329 | 105855 | 1 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL28055 | 105855 | 1 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
9805809 | 109864 | 8 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL307488 | 109864 | 8 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm00022a010 | |||
44334127 | 11406 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 522 | 6 | 0 | 2 | 7.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(F)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL102937 | 11406 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 522 | 6 | 0 | 2 | 7.7 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(F)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
44415554 | 145827 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 515 | 7 | 2 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](NCc2ncc[nH]2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL378609 | 145827 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 515 | 7 | 2 | 3 | 6.8 | C[C@@H](O[C@H]1CC[C@@H](NCc2ncc[nH]2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
136094860 | 212890 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 454 | 5 | 2 | 7 | 3.2 | COc1ccccc1[C@H]1COCC2(C1)OCCN(Cc1n[nH]c(O)n1)[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL85792 | 212890 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 454 | 5 | 2 | 7 | 3.2 | COc1ccccc1[C@H]1COCC2(C1)OCCN(Cc1n[nH]c(O)n1)[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
44433796 | 96967 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 5.3 | Cc1cnc(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL238220 | 96967 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 5.3 | Cc1cnc(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
44444677 | 161762 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 545 | 6 | 2 | 4 | 5.4 | C[C@@H](O[C@@H]1CN(C(=O)NCc2cn[nH]n2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
CHEMBL401281 | 161762 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 545 | 6 | 2 | 4 | 5.4 | C[C@@H](O[C@@H]1CN(C(=O)NCc2cn[nH]n2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2007.06.085 | |||
44312057 | 211231 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 690 | 7 | 2 | 5 | 7.7 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL72234 | 211231 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 690 | 7 | 2 | 5 | 7.7 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
24785978 | 128874 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596483 | 128874 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
10392925 | 21211 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 12 | 2 | 3 | 6.2 | CN(C)CCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL120081 | 21211 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 12 | 2 | 3 | 6.2 | CN(C)CCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
10076669 | 66992 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 567 | 10 | 2 | 3 | 6.3 | O=C(CCN1CCCCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL174016 | 66992 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 567 | 10 | 2 | 3 | 6.3 | O=C(CCN1CCCCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
11800025 | 128058 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 516 | 8 | 0 | 3 | 5.8 | CN(C)CCC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL357887 | 128058 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 516 | 8 | 0 | 3 | 5.8 | CN(C)CCC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
18669082 | 172495 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 487 | 6 | 1 | 3 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL424586 | 172495 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 487 | 6 | 1 | 3 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
18669082 | 172495 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 487 | 6 | 1 | 3 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL424586 | 172495 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 487 | 6 | 1 | 3 | 6.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL2115376 | 216046 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)[C@H]1CCc2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
44410191 | 147470 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 583 | 6 | 1 | 4 | 7.1 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2S(=O)(=O)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL381555 | 147470 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 583 | 6 | 1 | 4 | 7.1 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2S(=O)(=O)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
44415947 | 87078 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 526 | 7 | 1 | 3 | 7.4 | C[C@@H](O[C@H]1CC[C@@H](NCc2cccnc2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL214118 | 87078 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 526 | 7 | 1 | 3 | 7.4 | C[C@@H](O[C@H]1CC[C@@H](NCc2cccnc2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm0311487 | |||
44305288 | 209658 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 6.8 | CN(O)C(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL62649 | 209658 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 6.8 | CN(O)C(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
10392925 | 21211 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 12 | 2 | 3 | 6.2 | CN(C)CCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL120081 | 21211 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 12 | 2 | 3 | 6.2 | CN(C)CCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
18686789 | 99749 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 308 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CN2CCCC1C2c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2441369 | 99749 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 308 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CN2CCCC1C2c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
136094778 | 146039 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 515 | 8 | 4 | 6 | 3.8 | O=c1nc(C2CC3(c4ccccc4)NC2CCC3NCc2cc(OC(F)(F)F)ccc2OC2CC2)[nH][nH]1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL379010 | 146039 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 515 | 8 | 4 | 6 | 3.8 | O=c1nc(C2CC3(c4ccccc4)NC2CCC3NCc2cc(OC(F)(F)F)ccc2OC2CC2)[nH][nH]1 | 10.1016/j.bmcl.2005.11.026 | |||
10357939 | 124857 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 308 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CN2CCC[C@H]1[C@@H]2c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL340559 | 124857 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 308 | 4 | 0 | 3 | 3.7 | COc1ccccc1CN1CN2CCC[C@H]1[C@@H]2c1ccccc1 | 10.1021/jm9700171 | |||
44294291 | 107967 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 634 | 6 | 1 | 2 | 9.0 | CC(C)(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL295685 | 107967 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 634 | 6 | 1 | 2 | 9.0 | CC(C)(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44408158 | 146957 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 617 | 6 | 1 | 3 | 7.1 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCN(c3ccccc3)C(=O)C2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL380408 | 146957 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 617 | 6 | 1 | 3 | 7.1 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCN(c3ccccc3)C(=O)C2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
56662745 | 71417 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817889 | 71417 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817897 | 71417 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
10258336 | 108059 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL296397 | 108059 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
44307416 | 209787 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 474 | 6 | 1 | 3 | 5.2 | CNC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL63240 | 209787 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 474 | 6 | 1 | 3 | 5.2 | CNC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
10258336 | 108059 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL296397 | 108059 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44456703 | 165133 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CO)[C@@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL408960 | 165133 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CO)[C@@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.10.010 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.10.010 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmcl.2007.10.010 | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00037a009 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00037a009 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00037a009 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00037a009 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00037a009 | |||||
44412225 | 146487 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 463 | 4 | 1 | 2 | 6.0 | C[C@@H](O[C@H]1CCNC(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL379816 | 146487 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 463 | 4 | 1 | 2 | 6.0 | C[C@@H](O[C@H]1CCNC(=O)C[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.02.080 | |||
CHEMBL5269970 | 200392 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1252 | 41 | 16 | 16 | -2.3 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O | 10.1021/acs.jmedchem.6b01029 | |||
44407431 | 80004 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 500 | 8 | 3 | 7 | 3.9 | FC(F)(F)Oc1ccc(OC2CC2)c(CNC2CCC3NC2(c2ccccc2)CC3c2nnn[nH]2)c1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL201192 | 80004 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 500 | 8 | 3 | 7 | 3.9 | FC(F)(F)Oc1ccc(OC2CC2)c(CNC2CCC3NC2(c2ccccc2)CC3c2nnn[nH]2)c1 | 10.1016/j.bmcl.2005.11.026 | |||
10076383 | 108003 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 11 | 2 | 5 | 5.2 | CC(=O)N(Cc1ccccc1Cl)C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-n2ccnc2)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL296013 | 108003 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 555 | 11 | 2 | 5 | 5.2 | CC(=O)N(Cc1ccccc1Cl)C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-n2ccnc2)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2013.09.001 | |||
44408313 | 81277 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 610 | 4 | 1 | 4 | 6.5 | O=C1N([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)CCC1(O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL202884 | 81277 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 610 | 4 | 1 | 4 | 6.5 | O=C1N([C@]2(c3ccccc3)CC[C@@H](N3CCC4(CCOC4)CC3)CC2)CCC1(O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.111 | |||
52941550 | 24576 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258852 | 24576 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44433784 | 96965 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 540 | 5 | 0 | 2 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)C2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL238210 | 96965 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 540 | 5 | 0 | 2 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)C2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
44416136 | 86582 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 578 | 10 | 0 | 4 | 6.3 | COCCN(C)C(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL212025 | 86582 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 578 | 10 | 0 | 4 | 6.3 | COCCN(C)C(=O)CN(C)[C@@H]1CC[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2006.06.044 | |||
9855000 | 27393 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL130834 | 27393 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
10347274 | 135451 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 541 | 11 | 2 | 3 | 5.8 | CN(C)CCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL366818 | 135451 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 541 | 11 | 2 | 3 | 5.8 | CN(C)CCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80280-8 | |||
21955298 | 86404 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115006 | 86404 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL396426 | 219275 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
44415967 | 145479 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 526 | 7 | 1 | 3 | 7.4 | C[C@@H](O[C@H]1CC[C@@H](NCc2ccncc2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL377917 | 145479 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 526 | 7 | 1 | 3 | 7.4 | C[C@@H](O[C@H]1CC[C@@H](NCc2ccncc2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
10502796 | 39088 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 431 | 5 | 0 | 2 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL141034 | 39088 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 431 | 5 | 0 | 2 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
44578024 | 185473 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 396 | 6 | 2 | 3 | 4.9 | COc1ccc(C(F)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL468163 | 185473 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 396 | 6 | 2 | 3 | 4.9 | COc1ccc(C(F)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
10372941 | 126286 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 757 | 14 | 1 | 5 | 8.2 | COc1ccccc1CN(C)CCNC(=O)[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CCN1C(=O)N(c1ccccc1)c1cccc(Cl)c1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL345520 | 126286 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 757 | 14 | 1 | 5 | 8.2 | COc1ccccc1CN(C)CCNC(=O)[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CCN1C(=O)N(c1ccccc1)c1cccc(Cl)c1 | 10.1016/0960-894X(95)00080-D | |||
10885893 | 109689 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 525 | 10 | 3 | 5 | 5.6 | COC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL306089 | 109689 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 525 | 10 | 3 | 5 | 5.6 | COC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
10553959 | 194649 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
CHEMBL49638 | 194649 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
44305221 | 107805 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 4.7 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCNC3=O)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL294545 | 107805 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 4.7 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCNC3=O)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
10553959 | 194649 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL49638 | 194649 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44313273 | 211748 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 481 | 8 | 3 | 4 | 5.6 | C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL76501 | 211748 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 481 | 8 | 3 | 4 | 5.6 | C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
44433793 | 155163 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2cnccn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL393746 | 155163 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2cnccn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL396426 | 219275 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
22293505 | 196308 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 623 | 8 | 1 | 3 | 8.7 | OCC(OC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL51417 | 196308 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 623 | 8 | 1 | 3 | 8.7 | OCC(OC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
25028925 | 98140 | 4 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 5.5 | Cc1ccccc1[C@@H]1[C@@H](O[C@H](CO)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H]2CN(C3=NC(=O)CO3)C[C@H]21 | 10.1021/jm400751p | |||
CHEMBL2402572 | 98140 | 4 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 5.5 | Cc1ccccc1[C@@H]1[C@@H](O[C@H](CO)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H]2CN(C3=NC(=O)CO3)C[C@H]21 | 10.1021/jm400751p | |||
44358731 | 37113 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 609 | 7 | 1 | 3 | 7.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139167 | 37113 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 609 | 7 | 1 | 3 | 7.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
10077113 | 128321 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(/C=C/C(=O)NC1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
CHEMBL35857 | 128321 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(/C=C/C(=O)NC1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
22293475 | 193907 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL49176 | 193907 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44415444 | 86997 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 418 | 5 | 1 | 2 | 5.8 | OC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL213726 | 86997 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 418 | 5 | 1 | 2 | 5.8 | OC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
52949827 | 24114 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257357 | 24114 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL229280 | 216237 | 0 | None | 23 | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC[S+](C)[O-])NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
44333607 | 11747 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 469 | 6 | 0 | 3 | 5.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC3CC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL104883 | 11747 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 469 | 6 | 0 | 3 | 5.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC3CC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
10142159 | 88319 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 4 | 5.8 | O=C(CCc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12)N1CCC(O)(Cc2ccccc2)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21607 | 88319 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 4 | 5.8 | O=C(CCc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12)N1CCC(O)(Cc2ccccc2)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
44274180 | 169970 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 552 | 7 | 1 | 4 | 7.3 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccco3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL418186 | 169970 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 552 | 7 | 1 | 4 | 7.3 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccco3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
44433787 | 95307 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 555 | 5 | 1 | 2 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)NC2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL235219 | 95307 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 555 | 5 | 1 | 2 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)NC2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
11800024 | 215036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3n[nH]c(S)n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL98811 | 215036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3n[nH]c(S)n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
136180340 | 126387 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 488 | 9 | 2 | 5 | 5.3 | CCN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL346447 | 126387 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 488 | 9 | 2 | 5 | 5.3 | CCN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
10053205 | 123363 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL336589 | 123363 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
11800024 | 215036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3n[nH]c(S)n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL98811 | 215036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3n[nH]c(S)n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
44408123 | 147365 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 608 | 4 | 0 | 3 | 7.8 | O=C1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCN1[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL381362 | 147365 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 608 | 4 | 0 | 3 | 7.8 | O=C1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCN1[C@]1(c2ccccc2)CC[C@@H](N2CCC3(CCOC3)CC2)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
46881682 | 14869 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1091469 | 14869 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
10578351 | 127006 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 539 | 12 | 2 | 5 | 3.7 | COc1ccccc1CN(C=O)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL352176 | 127006 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 539 | 12 | 2 | 5 | 3.7 | COc1ccccc1CN(C=O)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
71449072 | 85353 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 645 | 5 | 2 | 3 | 7.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL2112212 | 85353 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 645 | 5 | 2 | 3 | 7.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00382-7 | |||
56668401 | 73217 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 505 | 7 | 0 | 4 | 6.1 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817890 | 73217 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 505 | 7 | 0 | 4 | 6.1 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852009 | 73217 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 505 | 7 | 0 | 4 | 6.1 | COc1ccc(OC(F)(F)F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
44415404 | 86816 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 514 | 7 | 1 | 3 | 5.8 | CN(C[C@@H]1CCC(=O)N1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212931 | 86816 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 514 | 7 | 1 | 3 | 5.8 | CN(C[C@@H]1CCC(=O)N1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
10721713 | 126815 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.5 | CCC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL350381 | 126815 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.5 | CCC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
18709649 | 171785 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 515 | 12 | 3 | 5 | 3.8 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(CO)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42259 | 171785 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 515 | 12 | 3 | 5 | 3.8 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(CO)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
44415550 | 172915 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL426145 | 172915 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46881820 | 14333 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(n3cnnc3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1087695 | 14333 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(n3cnnc3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44433792 | 155161 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2ncccn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL393745 | 155161 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2ncccn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
22901329 | 105855 | 1 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL28055 | 105855 | 1 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
22901329 | 105855 | 1 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL28055 | 105855 | 1 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
44294689 | 108390 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 542 | 5 | 2 | 3 | 6.2 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL298858 | 108390 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 542 | 5 | 2 | 3 | 6.2 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
11016806 | 211736 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 523 | 10 | 3 | 4 | 6.8 | CCC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL76455 | 211736 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 523 | 10 | 3 | 4 | 6.8 | CCC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
9829083 | 126917 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL351274 | 126917 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
10816374 | 25667 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 545 | 3 | 0 | 4 | 6.5 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL128384 | 25667 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 545 | 3 | 0 | 4 | 6.5 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00009-I | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00790 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00790 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00790 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
135547943 | 41201 | 26 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 4.8 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
CHEMBL142819 | 41201 | 26 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 516 | 6 | 2 | 5 | 4.8 | C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm980299k | |||
44456828 | 104356 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 490 | 4 | 0 | 2 | 5.8 | C[C@@H](O[C@H]1CN2C(=O)N(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL270751 | 104356 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 490 | 4 | 0 | 2 | 5.8 | C[C@@H](O[C@H]1CN2C(=O)N(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
44358610 | 36256 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 619 | 7 | 1 | 3 | 6.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1Br)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138463 | 36256 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 619 | 7 | 1 | 3 | 6.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1Br)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
10531050 | 127130 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL353093 | 127130 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
18669087 | 105506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL277880 | 105506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
18669087 | 105506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL277880 | 105506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44325035 | 118930 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 5.0 | COc1ccc(OC(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3nc[nH]n3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL329018 | 118930 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 5.0 | COc1ccc(OC(F)(F)F)cc1[C@H]1COC2(CCCN(Cc3nc[nH]n3)C2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
44415400 | 86868 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 5.9 | COC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL213134 | 86868 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 5.9 | COC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
9938657 | 66996 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
CHEMBL174038 | 66996 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
10502796 | 39088 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 431 | 5 | 0 | 2 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL141034 | 39088 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 431 | 5 | 0 | 2 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
11799022 | 11239 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3c[nH]cn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL101763 | 11239 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3c[nH]cn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
46881727 | 12366 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3ccn[nH]3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077241 | 12366 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3ccn[nH]3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
15549737 | 185595 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 378 | 6 | 2 | 3 | 4.4 | COc1ccc(CC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL469176 | 185595 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 378 | 6 | 2 | 3 | 4.4 | COc1ccc(CC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
44593633 | 189221 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 404 | 5 | 2 | 3 | 4.9 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL478620 | 189221 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 404 | 5 | 2 | 3 | 4.9 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)C(C(F)(F)F)CC2 | 10.1016/j.bmc.2008.06.047 | |||
44578056 | 196536 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 422 | 7 | 2 | 4 | 4.7 | COc1ccc(C(C)(OC)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL515935 | 196536 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 422 | 7 | 2 | 4 | 4.7 | COc1ccc(C(C)(OC)C(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/j.bmc.2008.06.047 | |||
19797472 | 125540 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 469 | 7 | 0 | 2 | 6.4 | Cc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc([Si](C)(C)C)c1 | 10.1021/jm00024a007 | |||
CHEMBL341863 | 125540 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 469 | 7 | 0 | 2 | 6.4 | Cc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc([Si](C)(C)C)c1 | 10.1021/jm00024a007 | |||
10341570 | 127852 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL357012 | 127852 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
58993655 | 128877 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 486 | 6 | 1 | 3 | 6.4 | N#Cc1cc(F)c(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596486 | 128877 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 486 | 6 | 1 | 3 | 6.4 | N#Cc1cc(F)c(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
24752434 | 15905 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1099372 | 15905 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL2370435 | 216628 | 0 | None | 48 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1021/jm8007618 | |||||
15639110 | 174921 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.6 | COc1ccccc1CN[C@H]1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL433020 | 174921 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.6 | COc1ccccc1CN[C@H]1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44274544 | 88301 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2cccnc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21602 | 88301 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2cccnc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
44328469 | 119017 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.6 | COc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL329090 | 119017 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.6 | COc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
24782914 | 128873 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 455 | 7 | 1 | 3 | 6.2 | COc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596482 | 128873 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 455 | 7 | 1 | 3 | 6.2 | COc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
46884431 | 14827 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 563 | 5 | 0 | 2 | 7.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccccc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091043 | 14827 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 563 | 5 | 0 | 2 | 7.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccccc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
10578269 | 41920 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1ccncc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL143464 | 41920 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1ccncc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
4898 | 9541 | 86 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmc.2013.09.001 | |||
5742 | 9541 | 86 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmc.2013.09.001 | |||
6451149 | 9541 | 86 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL206253 | 9541 | 86 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmc.2013.09.001 | |||
DB09048 | 9541 | 86 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmc.2013.09.001 | |||
10047566 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL422931 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
10047566 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL422931 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44415840 | 86741 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 589 | 7 | 0 | 4 | 6.0 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL212663 | 86741 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 589 | 7 | 0 | 4 | 6.0 | C[C@@H](O[C@H]1CC[C@@H](N(C)CC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
10049890 | 86787 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212839 | 86787 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
10047566 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL422931 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL389652 | 219209 | 0 | None | 2 | 4 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
11813209 | 211878 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 509 | 9 | 3 | 4 | 6.4 | CC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL77684 | 211878 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 509 | 9 | 3 | 4 | 6.4 | CC[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
18669072 | 90092 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 551 | 8 | 1 | 5 | 5.9 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(CCO)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21909 | 90092 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 551 | 8 | 1 | 5 | 5.9 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(CCO)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
10576865 | 214906 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 485 | 6 | 0 | 5 | 6.0 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nnco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL98022 | 214906 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 485 | 6 | 0 | 5 | 6.0 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nnco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
44433810 | 96654 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL237796 | 96654 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
9959724 | 171634 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 569 | 12 | 2 | 7 | 4.9 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-c2csnn2)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42191 | 171634 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 569 | 12 | 2 | 7 | 4.9 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(-c2csnn2)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
10531050 | 127130 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL353093 | 127130 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
489662 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL21815 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(98)00320-5 | |||
44297605 | 201466 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL53312 | 201466 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
9805809 | 109864 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm501535r | |||
CHEMBL307488 | 109864 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm501535r | |||
44338517 | 13107 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL108200 | 13107 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
9938657 | 66996 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
CHEMBL174038 | 66996 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
44346206 | 120438 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL332284 | 120438 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
10047567 | 213998 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
CHEMBL92701 | 213998 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
9890435 | 104219 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL27003 | 104219 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80534-5 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80534-5 | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
11799022 | 11239 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3c[nH]cn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL101763 | 11239 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 483 | 6 | 1 | 3 | 6.4 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3c[nH]cn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
44346206 | 120438 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL332284 | 120438 | 3 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
10576865 | 214906 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 485 | 6 | 0 | 5 | 6.0 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nnco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL98022 | 214906 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 485 | 6 | 0 | 5 | 6.0 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nnco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
10648551 | 215206 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 6.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3cocn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL99873 | 215206 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 6.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3cocn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
132846 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL1256740 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL27006 | 104223 | 23 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
489662 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21815 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
489662 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21815 | 89802 | 2 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Br)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
10648551 | 215206 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 6.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3cocn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL99873 | 215206 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 6.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3cocn3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
24799545 | 94196 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 439 | 7 | 0 | 4 | 4.9 | CCN(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333621 | 94196 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 439 | 7 | 0 | 4 | 4.9 | CCN(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
44407321 | 81182 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 494 | 8 | 3 | 5 | 4.5 | O=C(O)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL202568 | 81182 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 494 | 8 | 3 | 5 | 4.5 | O=C(O)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
44410193 | 147112 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 511 | 5 | 1 | 6 | 5.0 | Cn1nnc(C2CC3(c4ccccc4)NC2CCC3OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL380684 | 147112 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 511 | 5 | 1 | 6 | 5.0 | Cn1nnc(C2CC3(c4ccccc4)NC2CCC3OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.12.069 | |||
44297605 | 201466 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL53312 | 201466 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00319-9 | |||
44456580 | 162065 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN2C(=O)OC[C@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL402895 | 162065 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 477 | 4 | 0 | 3 | 5.9 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN2C(=O)OC[C@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
24889111 | 14696 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 656 | 7 | 1 | 4 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(NS(C)(=O)=O)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090287 | 14696 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 656 | 7 | 1 | 4 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(NS(C)(=O)=O)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52947645 | 24015 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256586 | 24015 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52948590 | 24079 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257235 | 24079 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52943994 | 24604 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258967 | 24604 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](N)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
10047566 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL422931 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
46227361 | 209362 | 0 | None | 14 | 4 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611925 | 209362 | 0 | None | 14 | 4 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL389652 | 219209 | 0 | None | -2 | 4 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||||
44335318 | 11877 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 603 | 8 | 2 | 3 | 5.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NC1(C(N)=O)CCCCC1)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL105600 | 11877 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 603 | 8 | 2 | 3 | 5.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NC1(C(N)=O)CCCCC1)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
44312285 | 109734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 703 | 7 | 2 | 4 | 7.6 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL306400 | 109734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 703 | 7 | 2 | 4 | 7.6 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
10047566 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
CHEMBL422931 | 172020 | 3 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
71450941 | 86294 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 595 | 5 | 2 | 3 | 6.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL2113739 | 86294 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 595 | 5 | 2 | 3 | 6.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
44305248 | 209666 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 585 | 8 | 1 | 3 | 7.0 | CN(C)CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL62679 | 209666 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 585 | 8 | 1 | 3 | 7.0 | CN(C)CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
9805809 | 109864 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL307488 | 109864 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acsmedchemlett.6b00381 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acsmedchemlett.6b00381 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acsmedchemlett.6b00381 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acsmedchemlett.6b00381 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acsmedchemlett.6b00381 | |||||
CHEMBL5284869 | 201047 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 533 | 6 | 1 | 6 | 4.9 | CN(C)Cc1[nH]nnc1CN1CCO[C@@]2(CC[C@@H](c3ccccc3C(F)(F)F)CO2)[C@@H]1c1ccc(F)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
10837742 | 192644 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 4.1 | NC(=O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
CHEMBL48680 | 192644 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 4.1 | NC(=O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
44318685 | 212781 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 533 | 6 | 1 | 6 | 4.9 | CN(C)Cc1n[nH]nc1CN1CCOC2(CCC(c3ccccc3C(F)(F)F)CO2)C1c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL84881 | 212781 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 533 | 6 | 1 | 6 | 4.9 | CN(C)Cc1n[nH]nc1CN1CCOC2(CCC(c3ccccc3C(F)(F)F)CO2)C1c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
44408124 | 82175 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 629 | 5 | 0 | 3 | 7.2 | O=C1CN([C@H]2CC[C@](c3ccccc3)(N3CCC(c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C3=O)CC2)CCN1c1ccccc1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL203961 | 82175 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 629 | 5 | 0 | 3 | 7.2 | O=C1CN([C@H]2CC[C@](c3ccccc3)(N3CCC(c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C3=O)CC2)CCN1c1ccccc1 | 10.1016/j.bmcl.2005.11.111 | |||
58993471 | 128875 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 6.2 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596484 | 128875 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 6.2 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1F | 10.1016/j.bmcl.2015.04.098 | |||
58993453 | 128879 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 484 | 6 | 1 | 3 | 6.7 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1Cl | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596488 | 128879 | 0 | None | - | 0 | Mongolian jird | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 484 | 6 | 1 | 3 | 6.7 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1Cl | 10.1016/j.bmcl.2015.04.098 | |||
56662745 | 71417 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817889 | 71417 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817897 | 71417 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
44415415 | 85752 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 5.8 | CN(Cc1nc[nH]n1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL211304 | 85752 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 5.8 | CN(Cc1nc[nH]n1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46884469 | 14765 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 594 | 6 | 0 | 4 | 7.2 | COc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090651 | 14765 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 594 | 6 | 0 | 4 | 7.2 | COc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
46881779 | 15222 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093750 | 15222 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44306210 | 109164 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 596 | 8 | 2 | 7 | 2.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2c(c1)OCCO2)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL303896 | 109164 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 596 | 8 | 2 | 7 | 2.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2c(c1)OCCO2)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44335372 | 11546 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 605 | 7 | 2 | 3 | 5.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL103979 | 11546 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 605 | 7 | 2 | 3 | 5.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00631-x | |||
10414428 | 11625 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 523 | 4 | 1 | 4 | 5.7 | Cn1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccc(F)cc2)c2cccnc2c1=O | 10.1021/jm00016a014 | |||
CHEMBL104301 | 11625 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 523 | 4 | 1 | 4 | 5.7 | Cn1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccc(F)cc2)c2cccnc2c1=O | 10.1021/jm00016a014 | |||
44358603 | 125823 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 633 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccccc1Br)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL342662 | 125823 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 633 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccccc1Br)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
9959330 | 202336 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL554713 | 202336 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
10578969 | 64000 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 570 | 11 | 1 | 6 | 4.8 | COc1ccccc1CN(CC(Cc1csc2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL165007 | 64000 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 570 | 11 | 1 | 6 | 4.8 | COc1ccccc1CN(CC(Cc1csc2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
10626048 | 125348 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 530 | 9 | 0 | 3 | 6.1 | CN(C)CCCC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL341599 | 125348 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 530 | 9 | 0 | 3 | 6.1 | CN(C)CCCC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
490428 | 126354 | 6 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL346154 | 126354 | 6 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44294535 | 110288 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 540 | 5 | 1 | 2 | 7.5 | CC1CCN([C@H]2CC[C@](NC(=O)C(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085128 | 110288 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 540 | 5 | 1 | 2 | 7.5 | CC1CCN([C@H]2CC[C@](NC(=O)C(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00250-0 | |||
24801458 | 94199 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 433 | 6 | 0 | 4 | 4.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCCC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333624 | 94199 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 433 | 6 | 0 | 4 | 4.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCCC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
44407422 | 148142 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 571 | 9 | 3 | 7 | 3.5 | CS(=O)(=O)NC(=O)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL383743 | 148142 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 571 | 9 | 3 | 7 | 3.5 | CS(=O)(=O)NC(=O)C1CC2(c3ccc(F)cc3)NC1CCC2NCc1cc(OC(F)(F)F)ccc1OC1CC1 | 10.1016/j.bmcl.2005.11.026 | |||
44410281 | 82343 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 525 | 5 | 1 | 6 | 5.5 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2c1nnnn1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL204573 | 82343 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 525 | 5 | 1 | 6 | 5.5 | C[C@@H](OC1CCC2NC1(c1ccccc1)CC2c1nnnn1C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
58993670 | 128880 | 0 | None | - | 0 | Mongolian jird | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 464 | 6 | 1 | 3 | 6.4 | Cc1cc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)ccc1C#N | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596489 | 128880 | 0 | None | - | 0 | Mongolian jird | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 464 | 6 | 1 | 3 | 6.4 | Cc1cc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)ccc1C#N | 10.1016/j.bmcl.2015.04.098 | |||
57399170 | 78428 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 458 | 7 | 1 | 5 | 3.5 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(S(C)(=O)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917842 | 78428 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 458 | 7 | 1 | 5 | 3.5 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(S(C)(=O)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963612 | 78428 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 458 | 7 | 1 | 5 | 3.5 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCN(S(C)(=O)=O)C[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
44456650 | 162273 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN(C(=O)OC(C)(C)C)[C@H]1CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL404089 | 162273 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@@H]1[C@@H](c2ccc(F)cc2)CN(C(=O)OC(C)(C)C)[C@H]1CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
52941570 | 24016 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256587 | 24016 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52943848 | 24192 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257588 | 24192 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
10052312 | 114167 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 518 | 4 | 0 | 3 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL317896 | 114167 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 518 | 4 | 0 | 3 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44338545 | 16107 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 4.2 | Brc1cc(I)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL111176 | 16107 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 4.2 | Brc1cc(I)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
9916428 | 119623 | 2 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)C1(NC(=O)c2c[nH]c3ccccc23)CCCCC1 | 10.1021/jm9700171 | |||
CHEMBL330888 | 119623 | 2 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)C1(NC(=O)c2c[nH]c3ccccc23)CCCCC1 | 10.1021/jm9700171 | |||
10793838 | 126864 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 611 | 13 | 2 | 7 | 3.6 | COC(=O)CC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL350846 | 126864 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 611 | 13 | 2 | 7 | 3.6 | COC(=O)CC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
9890435 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL27003 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9700171 | |||
44333692 | 11329 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 505 | 6 | 1 | 3 | 7.2 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(Nc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL102434 | 11329 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 505 | 6 | 1 | 3 | 7.2 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(Nc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
44270505 | 19138 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 470 | 9 | 2 | 3 | 4.1 | COc1ccccc1CN[C@H]1C2CC[N+](CC(N)=O)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL1185492 | 19138 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 470 | 9 | 2 | 3 | 4.1 | COc1ccccc1CN[C@H]1C2CC[N+](CC(N)=O)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL417263 | 19138 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 470 | 9 | 2 | 3 | 4.1 | COc1ccccc1CN[C@H]1C2CC[N+](CC(N)=O)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
9890435 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9506534 | |||
CHEMBL27003 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm9506534 | |||
9890435 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL27003 | 104219 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 6 | 1 | 3 | 4.9 | NC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
44318605 | 212645 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 425 | 3 | 1 | 4 | 4.5 | COc1ccc(C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL83772 | 212645 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 425 | 3 | 1 | 4 | 4.5 | COc1ccc(C(F)(F)F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
44456894 | 167317 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN2C(=O)OC[C@@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL411242 | 167317 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN2C(=O)OC[C@@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
10049890 | 86787 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212839 | 86787 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
22885690 | 148561 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 6.2 | C[C@@H](O[C@H]1CC[C@@H](N)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL386151 | 148561 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 6.2 | C[C@@H](O[C@H]1CC[C@@H](N)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
52942803 | 24018 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256589 | 24018 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
11756839 | 11970 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 532 | 4 | 0 | 3 | 6.8 | Cc1ccccc1-c1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
CHEMBL106087 | 11970 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 532 | 4 | 0 | 3 | 6.8 | Cc1ccccc1-c1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
44358676 | 36784 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1cccc2c1OCO2)N1CCN(C2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL138890 | 36784 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1cccc2c1OCO2)N1CCN(C2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
9850771 | 126656 | 3 | None | - | 0 | Mouse | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL348976 | 126656 | 3 | None | - | 0 | Mouse | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
44368171 | 52173 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 458 | 8 | 1 | 4 | 5.2 | CN(Cc1nc[nH]n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL152742 | 52173 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 458 | 8 | 1 | 4 | 5.2 | CN(Cc1nc[nH]n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
10460917 | 170528 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL420543 | 170528 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 583 | 11 | 2 | 4 | 5.5 | O=C(CCCN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
11568372 | 212804 | 5 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL85047 | 212804 | 5 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL5285318 | 201071 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 549 | 7 | 1 | 7 | 4.8 | CN(C)Cc1[nH]nnc1CN1CCO[C@@]2(CC[C@@H](c3ccccc3OC(F)(F)F)CO2)[C@@H]1c1ccc(F)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
44318672 | 212869 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 549 | 7 | 1 | 7 | 4.8 | CN(C)Cc1n[nH]nc1CN1CCOC2(CCC(c3ccccc3OC(F)(F)F)CO2)C1c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL85626 | 212869 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 549 | 7 | 1 | 7 | 4.8 | CN(C)Cc1n[nH]nc1CN1CCOC2(CCC(c3ccccc3OC(F)(F)F)CO2)C1c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
57390401 | 78382 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 2.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963299 | 78382 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 2.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL3216988 | 78382 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 2.9 | COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
44415986 | 87159 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 527 | 6 | 0 | 4 | 7.2 | C[C@@H](O[C@H]1CC[C@@H](N(C)c2cnccn2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
CHEMBL214472 | 87159 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 527 | 6 | 0 | 4 | 7.2 | C[C@@H](O[C@H]1CC[C@@H](N(C)c2cnccn2)[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.044 | |||
24889113 | 14720 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090450 | 14720 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1204418 | 14720 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46881728 | 12367 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 628 | 9 | 2 | 6 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3nn[nH]c3CN(C)C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077242 | 12367 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 628 | 9 | 2 | 6 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(NCc3nn[nH]c3CN(C)C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44335319 | 114287 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 626 | 8 | 2 | 4 | 5.7 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL318606 | 114287 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 626 | 8 | 2 | 4 | 5.7 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00631-x | |||
44370448 | 126537 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 717 | 18 | 1 | 5 | 8.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL347891 | 126537 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 717 | 18 | 1 | 5 | 8.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
44358604 | 35294 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 559 | 7 | 0 | 5 | 5.2 | CC(C)N1CCN(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cccc3c2OCO3)CC1 | 10.1021/jm000986n | |||
CHEMBL137609 | 35294 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 559 | 7 | 0 | 5 | 5.2 | CC(C)N1CCN(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cccc3c2OCO3)CC1 | 10.1021/jm000986n | |||
44358732 | 38025 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 587 | 7 | 0 | 3 | 6.9 | Cc1c(F)cccc1C(CN(C)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL140124 | 38025 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 587 | 7 | 0 | 3 | 6.9 | Cc1c(F)cccc1C(CN(C)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358428 | 125787 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 7 | 0 | 3 | 7.6 | CN(CC(c1cccc(C(F)(F)F)c1F)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL342607 | 125787 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 7 | 0 | 3 | 7.6 | CN(CC(c1cccc(C(F)(F)F)c1F)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990197+ | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990197+ | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990197+ | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990197+ | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990197+ | |||||
136180339 | 127882 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 406 | 8 | 2 | 5 | 4.2 | CN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(Cl)cc(Cl)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL357303 | 127882 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 406 | 8 | 2 | 5 | 4.2 | CN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(Cl)cc(Cl)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
10027219 | 106358 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.1 | NC(=O)C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL283872 | 106358 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.1 | NC(=O)C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
44274412 | 82813 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1ccc(-c2[nH]c3ccc(C)cc3c2CCC(=O)N2CCN(c3ccccc3OC)CC2)cc1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL20572 | 82813 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1ccc(-c2[nH]c3ccc(C)cc3c2CCC(=O)N2CCN(c3ccccc3OC)CC2)cc1 | 10.1016/s0960-894x(01)00183-4 | |||
44410283 | 145080 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 529 | 5 | 1 | 6 | 5.0 | Cn1nnc(C2(F)CC3(c4ccccc4)NC2CCC3OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL377091 | 145080 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 529 | 5 | 1 | 6 | 5.0 | Cn1nnc(C2(F)CC3(c4ccccc4)NC2CCC3OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.12.069 | |||
22293475 | 193907 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL49176 | 193907 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 620 | 6 | 1 | 2 | 8.8 | CC(NC(=O)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44408295 | 147103 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 7.6 | O=C1CN([C@H]2CC[C@](c3ccccc3)(N3CCCC(c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C3=O)CC2)CCN1c1ccccc1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL380651 | 147103 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 643 | 5 | 0 | 3 | 7.6 | O=C1CN([C@H]2CC[C@](c3ccccc3)(N3CCCC(c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C3=O)CC2)CCN1c1ccccc1 | 10.1016/j.bmcl.2005.11.111 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2011.02.031 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2011.02.031 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2011.02.031 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2011.02.031 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2011.02.031 | |||||
56662745 | 71417 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817889 | 71417 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817897 | 71417 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 499 | 6 | 0 | 3 | 6.0 | COc1ccc(Br)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.05.067 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.05.067 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.05.067 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.05.067 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.05.067 | |||||
44456625 | 175713 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN2C(=O)OC[C@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL438759 | 175713 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 459 | 4 | 0 | 3 | 5.8 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN2C(=O)OC[C@H]12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
44415403 | 145473 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 500 | 7 | 2 | 3 | 5.4 | O=C1CC[C@@H](CN[C@@H]2CC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H]2c2ccccc2)N1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL377881 | 145473 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 500 | 7 | 2 | 3 | 5.4 | O=C1CC[C@@H](CN[C@@H]2CC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H]2c2ccccc2)N1 | 10.1016/j.bmcl.2006.06.035 | |||
52941489 | 24503 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258623 | 24503 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52941506 | 24539 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258732 | 24539 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
71699792 | 131563 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 636 | 5 | 0 | 3 | 7.5 | CC(=O)C1CCC(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)[C@H](N(C)C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
CHEMBL3642162 | 131563 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 636 | 5 | 0 | 3 | 7.5 | CC(=O)C1CCC(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)[C@H](N(C)C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | nan | |||
19797432 | 44529 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 5.8 | COc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145800 | 44529 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 5.8 | COc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10438671 | 34121 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 607 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccc(F)cc1Cl)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL136764 | 34121 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 607 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccc(F)cc1Cl)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
44358707 | 38231 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1cccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL140299 | 38231 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1cccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
9850771 | 126656 | 3 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL348976 | 126656 | 3 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
10076881 | 169695 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 577 | 5 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCNC2=O)ccc1-c1ccccc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL417407 | 169695 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 577 | 5 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCNC2=O)ccc1-c1ccccc1 | 10.1016/s0960-894x(02)00382-7 | |||
10627355 | 126788 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
CHEMBL350151 | 126788 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
44338518 | 14494 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2ccccc2Cl)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL108889 | 14494 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2ccccc2Cl)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44338359 | 170208 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2cccc(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL419742 | 170208 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2cccc(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
132629 | 9017 | 15 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/jm034219a | |||
2104 | 9017 | 15 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/jm034219a | |||
CHEMBL24999 | 9017 | 15 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 508 | 6 | 1 | 2 | 5.7 | Ic1ccccc1CN[C@@H]1C2CCN([C@@H]1C(c1ccccc1)c1ccccc1)CC2 | 10.1021/jm034219a | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00035a006 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00035a006 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00035a006 | |||
21050485 | 174744 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 540 | 5 | 1 | 3 | 6.4 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(=O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL431732 | 174744 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 540 | 5 | 1 | 3 | 6.4 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(=O)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
24799366 | 94193 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 453 | 8 | 0 | 4 | 5.3 | CCN(CC)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333618 | 94193 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 453 | 8 | 0 | 4 | 5.3 | CCN(CC)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
10648288 | 108677 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 477 | 6 | 0 | 5 | 4.8 | COC(=O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
CHEMBL300856 | 108677 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 477 | 6 | 0 | 5 | 4.8 | COC(=O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
24785977 | 128847 | 0 | None | - | 0 | Mongolian jird | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccncc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596456 | 128847 | 0 | None | - | 0 | Mongolian jird | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccncc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/acs.jmedchem.6b01029 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/acs.jmedchem.6b01029 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/acs.jmedchem.6b01029 | |||
10414293 | 44227 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145535 | 44227 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/s0960-894x(98)00395-3 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/s0960-894x(98)00395-3 | |||
44396853 | 74047 | 9 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
CHEMBL188166 | 74047 | 9 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm0311487 | |||
21994307 | 33587 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 585 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL136305 | 33587 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 585 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358471 | 36940 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 585 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2c1OCO2)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139015 | 36940 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 585 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2c1OCO2)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00066a015 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00066a015 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00066a015 | |||
10394703 | 201746 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 669 | 9 | 1 | 5 | 6.3 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54540 | 201746 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 669 | 9 | 1 | 5 | 6.3 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
135480369 | 40485 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 514 | 7 | 2 | 5 | 5.3 | Oc1n[nH]c(CN2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)n1 | 10.1021/jm980376b | |||
CHEMBL142216 | 40485 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 514 | 7 | 2 | 5 | 5.3 | Oc1n[nH]c(CN2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)n1 | 10.1021/jm980376b | |||
44274269 | 83806 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccccn3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL20717 | 83806 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccccn3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
22293476 | 86403 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 592 | 7 | 1 | 2 | 8.7 | Fc1ccc(C2CCN([C@H]3CC[C@](CNCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115005 | 86403 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 592 | 7 | 1 | 2 | 8.7 | Fc1ccc(C2CCN([C@H]3CC[C@](CNCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
24889283 | 15203 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 597 | 6 | 0 | 5 | 7.3 | CC(C)c1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093595 | 15203 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 597 | 6 | 0 | 5 | 7.3 | CC(C)c1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
52948931 | 24021 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256592 | 24021 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
52941351 | 24150 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257466 | 24150 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 531 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@H](O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
44306310 | 109097 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 588 | 8 | 2 | 5 | 4.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL303548 | 109097 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 588 | 8 | 2 | 5 | 4.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44306023 | 109163 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 577 | 8 | 3 | 5 | 3.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL303890 | 109163 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 577 | 8 | 3 | 5 | 3.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
10100236 | 35587 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 607 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccc(F)c(Cl)c1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL137887 | 35587 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 607 | 7 | 0 | 3 | 7.2 | CN(CC(c1ccc(F)c(Cl)c1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
44358470 | 36701 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 593 | 7 | 1 | 3 | 6.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)cc1Cl)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138825 | 36701 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 593 | 7 | 1 | 3 | 6.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)cc1Cl)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358561 | 37249 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 627 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc(C(F)(F)F)c1F)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139286 | 37249 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 627 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc(C(F)(F)F)c1F)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm000316h | |||||
10075595 | 67121 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 527 | 10 | 2 | 3 | 5.4 | CN(C)CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL174526 | 67121 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 527 | 10 | 2 | 3 | 5.4 | CN(C)CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
10554361 | 37634 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1cccnc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL139719 | 37634 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1cccnc1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
10529338 | 38191 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(Cc3nc[nH]n3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL140263 | 38191 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(Cc3nc[nH]n3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
10840066 | 123498 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1ccccn1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL337358 | 123498 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 536 | 7 | 0 | 3 | 6.4 | O=C(Cc1ccccn1)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
71541574 | 94186 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 394 | 7 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C3CC3)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333611 | 94186 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 394 | 7 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C3CC3)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
44307181 | 210497 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.3 | NC(=O)CCN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL67667 | 210497 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.3 | NC(=O)CCN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
58993542 | 128886 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 7 | 0 | 3 | 7.0 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCN(C4CC4)CC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596495 | 128886 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 7 | 0 | 3 | 7.0 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCN(C4CC4)CC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
46884432 | 14694 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 5 | 0 | 3 | 7.7 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(C#N)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090285 | 14694 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 5 | 0 | 3 | 7.7 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(C#N)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52947647 | 24019 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256590 | 24019 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@H](NCc4ccccc4)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24752718 | 13315 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1082896 | 13315 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24750734 | 14785 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090742 | 14785 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)CC(N)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
44306218 | 169353 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 554 | 8 | 3 | 6 | 2.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL416864 | 169353 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 554 | 8 | 3 | 6 | 2.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44370973 | 53539 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 726 | 20 | 2 | 6 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(CC(N)=O)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL153976 | 53539 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 726 | 20 | 2 | 6 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(CC(N)=O)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
44370354 | 127994 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 774 | 19 | 2 | 6 | 7.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(CC(N)=O)C(=O)OCc2ccccc2)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL357757 | 127994 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 774 | 19 | 2 | 6 | 7.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(CC(N)=O)C(=O)OCc2ccccc2)C1 | 10.1016/0960-894X(95)00080-D | |||
10462250 | 128171 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 683 | 18 | 1 | 5 | 7.5 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL358173 | 128171 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 683 | 18 | 1 | 5 | 7.5 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
44358720 | 35273 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 609 | 7 | 0 | 3 | 6.8 | CN(CC(c1ccc(F)c(F)c1F)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL137580 | 35273 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 609 | 7 | 0 | 3 | 6.8 | CN(CC(c1ccc(F)c(F)c1F)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
44358657 | 37177 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL139226 | 37177 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
10816935 | 124885 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.2 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL340732 | 124885 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.2 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
46881821 | 12372 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)CC(NCc3ccn[nH]3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1077281 | 12372 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 570 | 7 | 2 | 4 | 5.6 | C[C@@H](O[C@H]1CN2C(=O)CC(NCc3ccn[nH]3)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
71541373 | 94200 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 463 | 6 | 0 | 4 | 5.0 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC4CC43)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333625 | 94200 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 463 | 6 | 0 | 4 | 5.0 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC4CC43)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
24800231 | 94212 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.3 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333637 | 94212 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.3 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
24785712 | 128882 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 451 | 6 | 1 | 4 | 5.5 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596491 | 128882 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 451 | 6 | 1 | 4 | 5.5 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2015.04.098 | |||
57393953 | 78390 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 460 | 7 | 1 | 7 | 3.7 | CCN1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917849 | 78390 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 460 | 7 | 1 | 7 | 3.7 | CCN1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963369 | 78390 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 460 | 7 | 1 | 7 | 3.7 | CCN1CC[C@H](NCc2cc(-n3nnnc3C(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
44415443 | 84710 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 431 | 6 | 1 | 2 | 6.0 | CNC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL209531 | 84710 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 431 | 6 | 1 | 2 | 6.0 | CNC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44415485 | 86685 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 8 | 2 | 3 | 4.9 | NC(=O)CNC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212439 | 86685 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 8 | 2 | 3 | 4.9 | NC(=O)CNC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44415502 | 86812 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 8 | 1 | 3 | 5.2 | CN(CC(N)=O)C[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212919 | 86812 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 8 | 1 | 3 | 5.2 | CN(CC(N)=O)C[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46884517 | 14864 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 643 | 7 | 0 | 4 | 8.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(Cc4ccccc4)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091341 | 14864 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 643 | 7 | 0 | 4 | 8.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(Cc4ccccc4)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
24768572 | 14541 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 624 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089270 | 14541 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 624 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCN(C(C)(C)C)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52947645 | 24015 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256586 | 24015 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 596 | 5 | 0 | 4 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
46947062 | 24232 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1257706 | 24232 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 545 | 4 | 1 | 3 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)[C@H]3C[C@@](C)(O)C[C@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
24752718 | 13315 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1082896 | 13315 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 542 | 5 | 0 | 5 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(n3cnnc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
19797432 | 44529 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 5.8 | COc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145800 | 44529 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 427 | 7 | 0 | 3 | 5.8 | COc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10650469 | 64213 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 557 | 10 | 2 | 4 | 4.7 | CC(=O)N(Cc1ccccc1Cl)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL165498 | 64213 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 557 | 10 | 2 | 4 | 4.7 | CC(=O)N(Cc1ccccc1Cl)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44328374 | 214766 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.9 | COc1ccccc1CNC1C2CC3CCCC2CN3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL97241 | 214766 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.9 | COc1ccccc1CNC1C2CC3CCCC2CN3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
11755361 | 123346 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(F)cc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL336439 | 123346 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(F)cc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
15639149 | 119686 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.9 | COc1ccccc1CN[C@H]1C2CC3CCCC2CN3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL331059 | 119686 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.9 | COc1ccccc1CN[C@H]1C2CC3CCCC2CN3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
10413173 | 36431 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 487 | 8 | 3 | 3 | 5.7 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c(F)c1 | 10.1021/jm00022a010 | |||
CHEMBL138620 | 36431 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 487 | 8 | 3 | 3 | 5.7 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c(F)c1 | 10.1021/jm00022a010 | |||
44346149 | 22289 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 518 | 6 | 1 | 2 | 7.1 | FC(F)(F)c1cc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL121742 | 22289 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 518 | 6 | 1 | 2 | 7.1 | FC(F)(F)c1cc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44346551 | 22354 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 481 | 8 | 0 | 2 | 7.0 | CN(C)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL122119 | 22354 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 481 | 8 | 0 | 2 | 7.0 | CN(C)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
10359664 | 120779 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 336 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)NC1 | 10.1021/jm9700171 | |||
CHEMBL332644 | 120779 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 336 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)NC1 | 10.1021/jm9700171 | |||
54581461 | 68037 | 0 | None | -6 | 4 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
CHEMBL1766207 | 68037 | 0 | None | -6 | 4 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
10254526 | 107272 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 479 | 7 | 0 | 1 | 6.9 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL291025 | 107272 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 479 | 7 | 0 | 1 | 6.9 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
44368083 | 51733 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.3 | Cn1nnnc1CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL152339 | 51733 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.3 | Cn1nnnc1CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
10457416 | 21658 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL120781 | 21658 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
10098987 | 66755 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173396 | 66755 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 547 | 9 | 2 | 3 | 6.1 | O=C(Cc1ccncc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
14986135 | 170180 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL419500 | 170180 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44402934 | 77847 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 9 | 1 | 3 | 6.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NCCN1CCCCC1)Cc1ccc(Cl)cc1 | 10.1021/jm058225d | |||
CHEMBL195222 | 77847 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 9 | 1 | 3 | 6.2 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NCCN1CCCCC1)Cc1ccc(Cl)cc1 | 10.1021/jm058225d | |||
44359091 | 38022 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 505 | 8 | 3 | 3 | 6.4 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc2ccccc2c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL140123 | 38022 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 505 | 8 | 3 | 3 | 6.4 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc2ccccc2c1)c1ccccc1 | 10.1021/jm00022a010 | |||
44346420 | 21077 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
CHEMBL119990 | 21077 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
44318657 | 212698 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 375 | 3 | 1 | 4 | 3.6 | COc1ccc(F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL84090 | 212698 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 375 | 3 | 1 | 4 | 3.6 | COc1ccc(F)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL2371978 | 216951 | 0 | None | 30 | 3 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
18391045 | 107172 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 487 | 6 | 2 | 3 | 4.0 | NC(=O)CN[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL290043 | 107172 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 487 | 6 | 2 | 3 | 4.0 | NC(=O)CN[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
44288896 | 175766 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1)c1ccnc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43912 | 175766 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1)c1ccnc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
19098237 | 43895 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145265 | 43895 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
44312056 | 211502 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 595 | 7 | 2 | 4 | 6.2 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3cc(C)cc(C)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL74237 | 211502 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 595 | 7 | 2 | 4 | 6.2 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3cc(C)cc(C)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
44358585 | 38040 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 615 | 9 | 0 | 5 | 6.4 | COc1cccc(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1OC | 10.1021/jm000986n | |||
CHEMBL140134 | 38040 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 615 | 9 | 0 | 5 | 6.4 | COc1cccc(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1OC | 10.1021/jm000986n | |||
18709652 | 175065 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 515 | 12 | 2 | 5 | 4.3 | COc1ccc(OCC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL434012 | 175065 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 515 | 12 | 2 | 5 | 4.3 | COc1ccc(OCC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
44306230 | 107532 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 594 | 8 | 2 | 6 | 4.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1csc2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL292799 | 107532 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 594 | 8 | 2 | 6 | 4.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1csc2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44319057 | 212623 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 605 | 10 | 1 | 6 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3cccc(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL83585 | 212623 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 605 | 10 | 1 | 6 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3cccc(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
19049350 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL281940 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
19049350 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL281940 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
19049350 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL281940 | 106056 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
44346694 | 121588 | 1 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL334072 | 121588 | 1 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 453 | 7 | 1 | 2 | 6.4 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44289443 | 175851 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 502 | 11 | 2 | 5 | 4.4 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CSc1ccccn1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL43970 | 175851 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 502 | 11 | 2 | 5 | 4.4 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CSc1ccccn1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
44297749 | 201241 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)cc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL52892 | 201241 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)cc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44333579 | 11154 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 506 | 7 | 2 | 4 | 5.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C(N)=O)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL101288 | 11154 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 506 | 7 | 2 | 4 | 5.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C(N)=O)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
44338510 | 15405 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL109514 | 15405 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00563-2 | |||
44338531 | 16130 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.4 | CC(C)(C)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL111304 | 16130 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.4 | CC(C)(C)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44322648 | 213097 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 386 | 6 | 1 | 3 | 4.1 | Cc1cc(C)cc(OCC(=O)N(Cc2cccc(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL87194 | 213097 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 386 | 6 | 1 | 3 | 4.1 | Cc1cc(C)cc(OCC(=O)N(Cc2cccc(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
44322525 | 213352 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 492 | 6 | 1 | 2 | 6.1 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccccc1Cl)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL88810 | 213352 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 492 | 6 | 1 | 2 | 6.1 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccccc1Cl)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
10095174 | 213442 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 5.5 | O=C(COc1cc(Cl)cc(Cl)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL89385 | 213442 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 5.5 | O=C(COc1cc(Cl)cc(Cl)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44415470 | 172623 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@H]1CC[C@@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL424883 | 172623 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@H]1CC[C@@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46884433 | 14695 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 581 | 5 | 0 | 2 | 7.9 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(F)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090286 | 14695 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 581 | 5 | 0 | 2 | 7.9 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(F)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44294395 | 193974 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(CCO)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
74972677 | 193974 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(CCO)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL49233 | 193974 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(CCO)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
15755315 | 169960 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 731 | 16 | 4 | 9 | 4.0 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccc(Cl)cc1 | 10.1021/jm00089a011 | |||
CHEMBL418124 | 169960 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 731 | 16 | 4 | 9 | 4.0 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccc(Cl)cc1 | 10.1021/jm00089a011 | |||
15755303 | 207127 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 596 | 15 | 4 | 7 | 3.1 | CC(C)C[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL59768 | 207127 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 596 | 15 | 4 | 7 | 3.1 | CC(C)C[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15755300 | 209756 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 630 | 15 | 4 | 7 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL63059 | 209756 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 630 | 15 | 4 | 7 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
44337428 | 14007 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 578 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1Br | 10.1021/jm970499g | |||
CHEMBL108575 | 14007 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 578 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1Br | 10.1021/jm970499g | |||
10793341 | 115617 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 | 10.1021/jm970499g | |||
CHEMBL320989 | 115617 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 | 10.1021/jm970499g | |||
44411742 | 85078 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 441 | 4 | 1 | 3 | 4.5 | O=C(CC1CCN(C(=O)c2cccc(C#Cc3ccccn3)c2)CC1)Nc1ccc(F)cc1 | 10.1016/j.bmcl.2006.02.027 | |||
CHEMBL210811 | 85078 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 441 | 4 | 1 | 3 | 4.5 | O=C(CC1CCN(C(=O)c2cccc(C#Cc3ccccn3)c2)CC1)Nc1ccc(F)cc1 | 10.1016/j.bmcl.2006.02.027 | |||
44344435 | 19858 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 473 | 5 | 1 | 3 | 6.1 | Cc1cc(C)cc(C(=O)N2C3C=C(c4ccccc4)C2CC(NCc2ccnc4ccccc24)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL119025 | 19858 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 473 | 5 | 1 | 3 | 6.1 | Cc1cc(C)cc(C(=O)N2C3C=C(c4ccccc4)C2CC(NCc2ccnc4ccccc24)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
2125 | 9804 | 2 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 581 | 16 | 5 | 5 | 4.0 | NC(=O)NCCCCCCCNC(=O)[C@@](Cc1ccccc1)(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C | 10.1016/S0960-894X(00)80360-1 | |||
5311350 | 9804 | 2 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 581 | 16 | 5 | 5 | 4.0 | NC(=O)NCCCCCCCNC(=O)[C@@](Cc1ccccc1)(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C | 10.1016/S0960-894X(00)80360-1 | |||
CHEMBL444832 | 9804 | 2 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 581 | 16 | 5 | 5 | 4.0 | NC(=O)NCCCCCCCNC(=O)[C@@](Cc1ccccc1)(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C | 10.1016/S0960-894X(00)80360-1 | |||
44291515 | 107915 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 580 | 17 | 4 | 5 | 4.6 | CC(C)(C)OC(=O)N[C@@](C)(Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCCCCCCCCC(N)=O | 10.1016/S0960-894X(00)80360-1 | |||
CHEMBL295301 | 107915 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 580 | 17 | 4 | 5 | 4.6 | CC(C)(C)OC(=O)N[C@@](C)(Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCCCCCCCCC(N)=O | 10.1016/S0960-894X(00)80360-1 | |||
44291788 | 108189 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 553 | 16 | 4 | 5 | 4.7 | CC(C)(C)OC(=O)N[C@@](C)(Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCCCCCCCCO | 10.1016/S0960-894X(00)80360-1 | |||
CHEMBL297327 | 108189 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 553 | 16 | 4 | 5 | 4.7 | CC(C)(C)OC(=O)N[C@@](C)(Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCCCCCCCCO | 10.1016/S0960-894X(00)80360-1 | |||
44346650 | 121216 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 322 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)N1 | 10.1021/jm9700171 | |||
CHEMBL333308 | 121216 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 322 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)N1 | 10.1021/jm9700171 | |||
15755305 | 107762 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 663 | 16 | 4 | 9 | 3.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL294288 | 107762 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 663 | 16 | 4 | 9 | 3.1 | CC(C)C[C@H](NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15755312 | 107837 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 621 | 14 | 4 | 9 | 1.8 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C | 10.1021/jm00089a011 | |||
CHEMBL294737 | 107837 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 621 | 14 | 4 | 9 | 1.8 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C | 10.1021/jm00089a011 | |||
15755330 | 209596 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 761 | 16 | 5 | 6 | 6.7 | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL62349 | 209596 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 761 | 16 | 5 | 6 | 6.7 | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15755295 | 210046 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 595 | 15 | 4 | 8 | 1.0 | NC(=O)CC[C@H](NC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL64631 | 210046 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 595 | 15 | 4 | 8 | 1.0 | NC(=O)CC[C@H](NC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL1190873 | 215372 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | None | None | None | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12 | 10.1021/jm00089a011 | |||||
CHEMBL541800 | 215372 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | None | None | None | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12 | 10.1021/jm00089a011 | |||||
10840399 | 16147 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 549 | 9 | 2 | 4 | 4.4 | CN(Cc1ccncc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL111384 | 16147 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 549 | 9 | 2 | 4 | 4.4 | CN(Cc1ccncc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
15755333 | 107353 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 593 | 16 | 7 | 7 | -0.0 | NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/jm00089a011 | |||
CHEMBL291602 | 107353 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 593 | 16 | 7 | 7 | -0.0 | NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/jm00089a011 | |||
15755331 | 107625 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 761 | 16 | 5 | 6 | 6.7 | O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL293445 | 107625 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 761 | 16 | 5 | 6 | 6.7 | O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15755294 | 210093 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 561 | 13 | 4 | 8 | 0.6 | CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL64829 | 210093 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 561 | 13 | 4 | 8 | 0.6 | CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL64601 | 222634 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | None | None | None | N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00089a011 | |||||
10744888 | 115444 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.0 | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl)c1ccccc1 | 10.1021/jm970499g | |||
CHEMBL320762 | 115444 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.0 | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl)c1ccccc1 | 10.1021/jm970499g | |||
44337578 | 174866 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 545 | 9 | 2 | 5 | 4.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL432620 | 174866 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 545 | 9 | 2 | 5 | 4.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
15485361 | 104005 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 576 | 9 | 0 | 3 | 7.5 | CC(=O)C1(c2ccccc2)CCN(CCCC2(c3ccc(Cl)c(Cl)c3)CCC(=O)N(Cc3ccccc3)C2)CC1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL26860 | 104005 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 576 | 9 | 0 | 3 | 7.5 | CC(=O)C1(c2ccccc2)CCN(CCCC2(c3ccc(Cl)c(Cl)c3)CCC(=O)N(Cc3ccccc3)C2)CC1 | 10.1016/s0960-894x(98)00215-7 | |||
10362340 | 97045 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 3.4 | CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23851 | 97045 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 3.4 | CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
44274545 | 89286 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 561 | 8 | 0 | 4 | 7.3 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(CC3CC3)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21775 | 89286 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 561 | 8 | 0 | 4 | 7.3 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(CC3CC3)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44362598 | 43598 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145022 | 43598 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
10362340 | 97045 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 3.4 | CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL23851 | 97045 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 3.4 | CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00395-3 | |||
44312026 | 109628 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 439 | 7 | 2 | 2 | 4.8 | Cc1cc(C)cc(CN(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL305608 | 109628 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 439 | 7 | 2 | 2 | 4.8 | Cc1cc(C)cc(CN(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
44289232 | 176651 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccccc1Cl)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL444043 | 176651 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccccc1Cl)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10349900 | 113526 | 0 | None | - | 3 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144343 | 113526 | 0 | None | - | 3 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL2369600 | 216413 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
10477952 | 105764 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cccc(Cl)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL279916 | 105764 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cccc(Cl)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
19797474 | 44245 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 419 | 6 | 0 | 2 | 5.8 | Fc1ccc(F)c(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145552 | 44245 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 419 | 6 | 0 | 2 | 5.8 | Fc1ccc(F)c(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44384902 | 66721 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1cccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL173245 | 66721 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1cccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
44362586 | 44525 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(COC2C3CCN(CC3)C2Cc2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145799 | 44525 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(COC2C3CCN(CC3)C2Cc2ccccc2)c1 | 10.1021/jm00024a007 | |||
44276673 | 104132 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 604 | 7 | 1 | 4 | 6.6 | O=C(c1ccccc1)N1CCCC(CCCN2CCC3(CC2)CN(c2ccccc2)NC3=O)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL26951 | 104132 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 604 | 7 | 1 | 4 | 6.6 | O=C(c1ccccc1)N1CCCC(CCCN2CCC3(CC2)CN(c2ccccc2)NC3=O)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
44324705 | 119134 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 804 | 16 | 0 | 4 | 9.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL329445 | 119134 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 804 | 16 | 0 | 4 | 9.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44359056 | 126228 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 513 | 9 | 3 | 5 | 5.1 | COC(=O)c1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
CHEMBL345069 | 126228 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 513 | 9 | 3 | 5 | 5.1 | COC(=O)c1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
10039383 | 92252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm9700171 | |||
CHEMBL22680 | 92252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm9700171 | |||
44297603 | 169907 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cccc(Cl)c3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL417760 | 169907 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cccc(Cl)c3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
11683136 | 112580 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@@H]1CC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126963 | 112580 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@@H]1CC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
44333708 | 170155 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C(F)(F)F)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL419352 | 170155 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C(F)(F)F)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
11489471 | 101655 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 6 | 0 | 3 | 7.4 | COCc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL25398 | 101655 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 6 | 0 | 3 | 7.4 | COCc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
10389968 | 66667 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 470 | 4 | 1 | 3 | 5.7 | CC1(Cc2c[nH]c3ccccc23)OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
CHEMBL173014 | 66667 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 470 | 4 | 1 | 3 | 5.7 | CC1(Cc2c[nH]c3ccccc23)OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
21753663 | 203434 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 373 | 9 | 1 | 2 | 4.8 | Cc1cc(C)cc(COCC(NC=O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56442 | 203434 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 373 | 9 | 1 | 2 | 4.8 | Cc1cc(C)cc(COCC(NC=O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
71541576 | 94188 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 438 | 6 | 0 | 3 | 5.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333613 | 94188 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 438 | 6 | 0 | 3 | 5.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
24800927 | 94214 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 384 | 5 | 1 | 3 | 4.6 | FC(F)(F)c1cc(Cl)nc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333639 | 94214 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 384 | 5 | 1 | 3 | 4.6 | FC(F)(F)c1cc(Cl)nc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
44433783 | 96964 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 530 | 4 | 0 | 3 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL238209 | 96964 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 530 | 4 | 0 | 3 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
46883823 | 15204 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 5 | 1 | 4 | 6.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(N3CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093596 | 15204 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 5 | 1 | 4 | 6.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(N3CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
11705241 | 95010 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CCN1CCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347857 | 95010 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CCN1CCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
24993314 | 177818 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | CC1=C(N2C[C@H]3CC[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3C2)CCC1=O | 10.1021/jm8016514 | |||
CHEMBL445686 | 177818 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | CC1=C(N2C[C@H]3CC[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3C2)CCC1=O | 10.1021/jm8016514 | |||
44306115 | 210268 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 498 | 10 | 4 | 4 | 2.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CO)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL66151 | 210268 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 498 | 10 | 4 | 4 | 2.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CO)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44324814 | 213984 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 606 | 16 | 1 | 4 | 6.2 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(CC)CC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL92621 | 213984 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 606 | 16 | 1 | 4 | 6.2 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(CC)CC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44288901 | 170061 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 5.6 | CN(C)CCCOC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL418697 | 170061 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 5.6 | CN(C)CCCOC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
11318556 | 100710 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | CN(C)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL24829 | 100710 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.9 | CN(C)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
10840688 | 126979 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 564 | 11 | 1 | 5 | 4.7 | COc1ccccc1CN(CC(Cc1ccc2ccccc2c1)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL351940 | 126979 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 564 | 11 | 1 | 5 | 4.7 | COc1ccccc1CN(CC(Cc1ccc2ccccc2c1)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
44299464 | 206544 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 385 | 7 | 1 | 2 | 5.7 | NC(COCc1cc(Cl)cc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL59380 | 206544 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 385 | 7 | 1 | 2 | 5.7 | NC(COCc1cc(Cl)cc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
44306211 | 109113 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 592 | 8 | 2 | 5 | 4.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2c(c1)CCCC2)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL303680 | 109113 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 592 | 8 | 2 | 5 | 4.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2c(c1)CCCC2)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
46884467 | 14763 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 582 | 5 | 0 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccnc(F)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090649 | 14763 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 582 | 5 | 0 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccnc(F)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
10202046 | 127839 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL356912 | 127839 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
10407571 | 174736 | 10 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80246-2 | |||
CHEMBL431690 | 174736 | 10 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80246-2 | |||
44307162 | 210139 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 0 | 2 | 7.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccccc3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL65153 | 210139 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 0 | 2 | 7.6 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccccc3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00009-I | |||
71583096 | 94995 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347694 | 94995 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmc.2013.02.010 | |||
15755296 | 109060 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 670 | 14 | 4 | 9 | 3.5 | C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL303337 | 109060 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 670 | 14 | 4 | 9 | 3.5 | C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15755297 | 109436 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 656 | 14 | 4 | 9 | 3.1 | CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL304472 | 109436 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 656 | 14 | 4 | 9 | 3.1 | CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
10256518 | 104170 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 532 | 5 | 0 | 3 | 6.4 | CN(Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00016a014 | |||
CHEMBL269781 | 104170 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 532 | 5 | 0 | 3 | 6.4 | CN(Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00016a014 | |||
10363425 | 171387 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 397 | 4 | 1 | 3 | 4.9 | CN(Cc1ccccc1)C(=O)Nc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL421591 | 171387 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 397 | 4 | 1 | 3 | 4.9 | CN(Cc1ccccc1)C(=O)Nc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44288846 | 175115 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 485 | 6 | 1 | 3 | 6.4 | O=C(c1cccc2ccccc12)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43432 | 175115 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 485 | 6 | 1 | 3 | 6.4 | O=C(c1cccc2ccccc12)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10317821 | 43563 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 383 | 6 | 0 | 2 | 5.5 | c1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL144996 | 43563 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 383 | 6 | 0 | 2 | 5.5 | c1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44358472 | 123573 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 6.1 | COc1ccc(OC)c(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL337803 | 123573 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 6.1 | COc1ccc(OC)c(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
44294321 | 18822 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.5 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3cc(Cl)c(Cl)cc3nc21 | 10.1021/jm00109a034 | |||
54093758 | 18822 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.5 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3cc(Cl)c(Cl)cc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183502 | 18822 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.5 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3cc(Cl)c(Cl)cc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL301168 | 18822 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.5 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3cc(Cl)c(Cl)cc3nc21 | 10.1021/jm00109a034 | |||
15037921 | 126403 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 444 | 8 | 1 | 2 | 6.2 | Clc1ccccc1CCCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL346626 | 126403 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 444 | 8 | 1 | 2 | 6.2 | Clc1ccccc1CCCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
68928842 | 131576 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 600 | 5 | 1 | 5 | 4.1 | CN(C(=O)c1ccc(C(F)(F)F)cn1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
CHEMBL3642175 | 131576 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 600 | 5 | 1 | 5 | 4.1 | CN(C(=O)c1ccc(C(F)(F)F)cn1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
44312218 | 210919 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 542 | 8 | 1 | 4 | 5.5 | CSN1CC2(CCN(C(=O)N[C@@H](CCc3ccccc3)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL70461 | 210919 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 542 | 8 | 1 | 4 | 5.5 | CSN1CC2(CCN(C(=O)N[C@@H](CCc3ccccc3)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
10506929 | 63353 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)cc1 | 10.1021/jm950616c | |||
CHEMBL164175 | 63353 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)cc1 | 10.1021/jm950616c | |||
44328416 | 214720 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 6 | 1 | 2 | 6.6 | FC(F)(F)c1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL96956 | 214720 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 6 | 1 | 2 | 6.6 | FC(F)(F)c1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
10039383 | 92252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm980376b | |||
CHEMBL22680 | 92252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 281 | 5 | 1 | 2 | 3.5 | c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm980376b | |||
19797452 | 128307 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL358529 | 128307 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44287503 | 106982 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 465 | 7 | 1 | 1 | 6.6 | O=C(CC(c1ccccc1)c1ccccc1)NCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL288340 | 106982 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 465 | 7 | 1 | 1 | 6.6 | O=C(CC(c1ccccc1)c1ccccc1)NCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44299829 | 205855 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.4 | FC(F)(F)c1cc(CC[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL58774 | 205855 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.4 | FC(F)(F)c1cc(CC[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
44287541 | 166436 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.6 | CN(CC(c1ccccc1)c1ccccc1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL41038 | 166436 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.6 | CN(CC(c1ccccc1)c1ccccc1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL449091 | 220739 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | C/C=C/CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
10692651 | 107866 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL294960 | 107866 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
19003165 | 108951 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COCC(N)Cc2cccc3ccccc23)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL302719 | 108951 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COCC(N)Cc2cccc3ccccc23)c1 | 10.1016/S0960-894X(00)80063-3 | |||
3198 | 212292 | 76 | None | -37 | 34 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
CHEMBL1201049 | 212292 | 76 | None | -37 | 34 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
CHEMBL808 | 212292 | 76 | None | -37 | 34 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
44297683 | 174969 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL433285 | 174969 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
9869033 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL290364 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
71541468 | 94208 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 424 | 6 | 0 | 3 | 5.5 | CC(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333633 | 94208 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 424 | 6 | 0 | 3 | 5.5 | CC(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
24801626 | 94215 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 398 | 5 | 0 | 3 | 4.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333640 | 94215 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 398 | 5 | 0 | 3 | 4.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
57403990 | 77729 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 6 | 1 | 3 | 4.5 | CC(=O)NCC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951620 | 77729 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 6 | 1 | 3 | 4.5 | CC(=O)NCC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
44335410 | 11772 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 574 | 7 | 1 | 2 | 7.5 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NC1CCCCCC1)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL105009 | 11772 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 574 | 7 | 1 | 2 | 7.5 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)NC1CCCCCC1)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(01)00631-x | |||
44288885 | 107060 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 500 | 8 | 1 | 4 | 4.9 | COc1cc(CC(=O)N[C@H]2CCN(C(=O)c3cc(C)cc(C)c3)[C@H](Cc3ccccc3)C2)cc(OC)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL289026 | 107060 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 500 | 8 | 1 | 4 | 4.9 | COc1cc(CC(=O)N[C@H]2CCN(C(=O)c3cc(C)cc(C)c3)[C@H](Cc3ccccc3)C2)cc(OC)c1 | 10.1016/0960-894X(96)00287-9 | |||
44396809 | 173146 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 462 | 6 | 1 | 2 | 6.5 | Cc1cc(C)cc(C(=O)N2CCC(NCc3cccc4ccccc34)CC2Cc2ccccc2)c1 | 10.1021/jm0311487 | |||
CHEMBL427514 | 173146 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 462 | 6 | 1 | 2 | 6.5 | Cc1cc(C)cc(C(=O)N2CCC(NCc3cccc4ccccc34)CC2Cc2ccccc2)c1 | 10.1021/jm0311487 | |||
44358709 | 36563 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 645 | 10 | 0 | 6 | 6.4 | COc1ccc(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c(OC)c1OC | 10.1021/jm000986n | |||
CHEMBL138715 | 36563 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 645 | 10 | 0 | 6 | 6.4 | COc1ccc(C(CN(C)C(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c(OC)c1OC | 10.1021/jm000986n | |||
44358679 | 36629 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 611 | 6 | 0 | 4 | 7.4 | COc1ccccc1C(C1CCCCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138770 | 36629 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 611 | 6 | 0 | 4 | 7.4 | COc1ccccc1C(C1CCCCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358680 | 123382 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 608 | 8 | 1 | 3 | 6.8 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(Cc1c[nH]c2ccccc12)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL336715 | 123382 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 608 | 8 | 1 | 3 | 6.8 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(Cc1c[nH]c2ccccc12)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358683 | 126148 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 497 | 7 | 0 | 5 | 4.8 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1ccccc1Cl | 10.1021/jm000986n | |||
CHEMBL344434 | 126148 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 497 | 7 | 0 | 5 | 4.8 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1ccccc1Cl | 10.1021/jm000986n | |||
9869033 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL290364 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
9869033 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL290364 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
9910357 | 18751 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 427 | 7 | 1 | 2 | 5.2 | COc1ccccc1CN[C@H]1C2CC[N+](C)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL1183052 | 18751 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 427 | 7 | 1 | 2 | 5.2 | COc1ccccc1CN[C@H]1C2CC[N+](C)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL277524 | 18751 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 427 | 7 | 1 | 2 | 5.2 | COc1ccccc1CN[C@H]1C2CC[N+](C)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
44338638 | 12496 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COC[C@@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL107829 | 12496 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COC[C@@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44338546 | 115385 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 382 | 6 | 1 | 3 | 4.0 | Fc1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL320535 | 115385 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 382 | 6 | 1 | 3 | 4.0 | Fc1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
9917079 | 67939 | 39 | None | - | 0 | Mongolian jird | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 619 | 5 | 1 | 3 | 7.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccc(Cl)cc2)C1)c1ccnc2ccccc12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765508 | 67939 | 39 | None | - | 0 | Mongolian jird | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 619 | 5 | 1 | 3 | 7.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccc(Cl)cc2)C1)c1ccnc2ccccc12 | 10.1016/j.bmc.2011.02.031 | |||
44346334 | 22017 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.0 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL121094 | 22017 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.0 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
10837362 | 37523 | 1 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 5 | 2 | 2 | 5.1 | FC(F)(F)c1cc(CNCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL139558 | 37523 | 1 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 5 | 2 | 2 | 5.1 | FC(F)(F)c1cc(CNCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
44299969 | 203975 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 373 | 9 | 1 | 2 | 5.6 | CCNC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56814 | 203975 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 373 | 9 | 1 | 2 | 5.6 | CCNC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
44359117 | 126111 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 525 | 9 | 3 | 5 | 6.0 | COc1cccc2cc(COC(=O)N[C@](C)(Cc3c[nH]c4ccccc34)C(=O)N[C@@H](C)c3ccccc3)oc12 | 10.1021/jm00022a010 | |||
CHEMBL344217 | 126111 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 525 | 9 | 3 | 5 | 6.0 | COc1cccc2cc(COC(=O)N[C@](C)(Cc3c[nH]c4ccccc34)C(=O)N[C@@H](C)c3ccccc3)oc12 | 10.1021/jm00022a010 | |||
44297491 | 202129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 578 | 10 | 1 | 7 | 3.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc([N+](=O)[O-])c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL55180 | 202129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 578 | 10 | 1 | 7 | 3.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc([N+](=O)[O-])c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
76325557 | 112576 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 514 | 6 | 0 | 3 | 6.4 | CN1CCN(C2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126959 | 112576 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 514 | 6 | 0 | 3 | 6.4 | CN1CCN(C2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
76325558 | 112585 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126968 | 112585 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
490428 | 126354 | 6 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL346154 | 126354 | 6 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
22293473 | 86407 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.8 | O=C(OC[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115009 | 86407 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.8 | O=C(OC[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
24783682 | 128850 | 0 | None | - | 0 | Mongolian jird | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 475 | 6 | 1 | 2 | 7.4 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc3ccccc3c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596459 | 128850 | 0 | None | - | 0 | Mongolian jird | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 475 | 6 | 1 | 2 | 7.4 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc3ccccc3c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
11724403 | 175324 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm00024a007 | |||
CHEMBL435564 | 175324 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm00024a007 | |||
9852911 | 106159 | 0 | None | 8 | 6 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 678 | 20 | 2 | 7 | 7.4 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm000316h | |||
CHEMBL282618 | 106159 | 0 | None | 8 | 6 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 678 | 20 | 2 | 7 | 7.4 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm000316h | |||
CHEMBL2372525 | 217049 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
CHEMBL5268296 | 200337 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 1264 | 38 | 15 | 16 | -2.1 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O | 10.1021/acs.jmedchem.6b01029 | |||
15118534 | 112967 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 0 | 1 | 5 | 4.6 | C#C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4Cc5nc6nc7ccccc7c(=O)n6cc5C[C@]4(C)[C@H]3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL3138259 | 112967 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 0 | 1 | 5 | 4.6 | C#C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4Cc5nc6nc7ccccc7c(=O)n6cc5C[C@]4(C)[C@H]3CC[C@@]21C | 10.1021/jm00080a025 | |||
11445389 | 195170 | 15 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 692 | 5 | 2 | 6 | 3.7 | CN1C(=O)[C@@H]2C[C@@]3([C@@]45C[C@H]6C(=O)N(C)[C@@H](Cc7ccccc7)C(=O)N6[C@@H]4Nc4ccccc45)c4ccccc4N[C@H]3N2C(=O)[C@@H]1Cc1ccccc1 | 10.1021/np50111a008 | |||
CHEMBL501675 | 195170 | 15 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 692 | 5 | 2 | 6 | 3.7 | CN1C(=O)[C@@H]2C[C@@]3([C@@]45C[C@H]6C(=O)N(C)[C@@H](Cc7ccccc7)C(=O)N6[C@@H]4Nc4ccccc45)c4ccccc4N[C@H]3N2C(=O)[C@@H]1Cc1ccccc1 | 10.1021/np50111a008 | |||
44287211 | 167314 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.9 | CN(C(=O)CC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL41124 | 167314 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.9 | CN(C(=O)CC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
16755229 | 180706 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 513 | 4 | 1 | 3 | 7.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2ccnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL454087 | 180706 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 513 | 4 | 1 | 3 | 7.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2ccnc12 | 10.1016/j.bmc.2008.05.067 | |||
10435750 | 106032 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 6 | 1 | 2 | 4.1 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)[N+](C)(C)C)c1 | 10.1021/jm00035a006 | |||
CHEMBL281804 | 106032 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 6 | 1 | 2 | 4.1 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)[N+](C)(C)C)c1 | 10.1021/jm00035a006 | |||
10506124 | 108037 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL296228 | 108037 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
10435750 | 106032 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 6 | 1 | 2 | 4.1 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)[N+](C)(C)C)c1 | 10.1021/jm00066a015 | |||
CHEMBL281804 | 106032 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 6 | 1 | 2 | 4.1 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)[N+](C)(C)C)c1 | 10.1021/jm00066a015 | |||
44312952 | 112172 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 668 | 16 | 6 | 6 | 2.4 | CC(=O)NC(C(=O)NCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
CHEMBL311688 | 112172 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 668 | 16 | 6 | 6 | 2.4 | CC(=O)NC(C(=O)NCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
44322649 | 170150 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 494 | 6 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccccc1Cl)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL419312 | 170150 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 494 | 6 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccccc1Cl)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44322524 | 213381 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 462 | 7 | 1 | 2 | 6.1 | Fc1ccc(CN(CCCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)cc1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL88998 | 213381 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 462 | 7 | 1 | 2 | 6.1 | Fc1ccc(CN(CCCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)cc1 | 10.1016/s0960-894x(01)00727-2 | |||
44322704 | 213501 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 4.8 | O=C(COc1cc(Cl)cc(Cl)c1)N(Cc1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL89847 | 213501 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 4.8 | O=C(COc1cc(Cl)cc(Cl)c1)N(Cc1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44346399 | 168448 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 536 | 9 | 3 | 3 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL413108 | 168448 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 536 | 9 | 3 | 3 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
44322678 | 213340 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 414 | 5 | 1 | 3 | 4.4 | O=C(COc1cc(F)cc(F)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL88731 | 213340 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 414 | 5 | 1 | 3 | 4.4 | O=C(COc1cc(F)cc(F)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44346333 | 19828 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 572 | 10 | 3 | 3 | 6.5 | CN(Cc1ccccc1)C[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL1190061 | 19828 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 572 | 10 | 3 | 3 | 6.5 | CN(Cc1ccccc1)C[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL540060 | 19828 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 572 | 10 | 3 | 3 | 6.5 | CN(Cc1ccccc1)C[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
10530444 | 126978 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 537 | 11 | 2 | 4 | 4.1 | CC(=O)N(CCc1ccccc1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL351922 | 126978 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 537 | 11 | 2 | 4 | 4.1 | CC(=O)N(CCc1ccccc1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44212284 | 66762 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c(OC)c1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL173420 | 66762 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c(OC)c1 | 10.1016/0960-894X(96)00148-5 | |||
19797443 | 172390 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL424307 | 172390 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10439730 | 113534 | 0 | None | 39 | 3 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144353 | 113534 | 0 | None | 39 | 3 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44346302 | 119878 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(CO[C@@H]2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm9700171 | |||
CHEMBL331392 | 119878 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(CO[C@@H]2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm9700171 | |||
11724403 | 175324 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL435564 | 175324 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
44333821 | 11548 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 457 | 5 | 0 | 3 | 5.6 | CC(C)N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL103984 | 11548 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 457 | 5 | 0 | 3 | 5.6 | CC(C)N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00616-3 | |||
44297293 | 177607 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 617 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](CSCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL445357 | 177607 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 617 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](CSCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44368118 | 126262 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 473 | 8 | 0 | 6 | 4.6 | CN(Cc1nnnn1C)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL345315 | 126262 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 473 | 8 | 0 | 6 | 4.6 | CN(Cc1nnnn1C)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
22859115 | 214010 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL92818 | 214010 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
44334143 | 11346 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 497 | 6 | 1 | 3 | 6.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL102569 | 11346 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 497 | 6 | 1 | 3 | 6.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
22859115 | 214010 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL92818 | 214010 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | N[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
2090 | 9543 | 25 | None | - | 4 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
5311312 | 9543 | 25 | None | - | 4 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL437797 | 9543 | 25 | None | - | 4 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
24801795 | 94204 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 490 | 6 | 0 | 5 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC(C#N)CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333629 | 94204 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 490 | 6 | 0 | 5 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC(C#N)CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
44318405 | 112358 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 357 | 3 | 1 | 4 | 3.4 | COc1ccccc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL312202 | 112358 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 357 | 3 | 1 | 4 | 3.4 | COc1ccccc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
24784192 | 128862 | 0 | None | - | 0 | Mongolian jird | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 441 | 6 | 2 | 3 | 5.9 | Oc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596471 | 128862 | 0 | None | - | 0 | Mongolian jird | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 441 | 6 | 2 | 3 | 5.9 | Oc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44297912 | 201467 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 527 | 10 | 1 | 5 | 5.0 | COc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL53314 | 201467 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 527 | 10 | 1 | 5 | 5.0 | COc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
44433786 | 153688 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 4 | 0 | 2 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)N2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392567 | 153688 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 4 | 0 | 2 | 6.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)N2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
46883824 | 15205 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093597 | 15205 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCC(O)CC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52941570 | 24016 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256587 | 24016 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52941550 | 24576 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258852 | 24576 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
10251123 | 11610 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 412 | 6 | 1 | 4 | 5.1 | COc1ccccc1CNCc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104225 | 11610 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 412 | 6 | 1 | 4 | 5.1 | COc1ccccc1CNCc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
44370893 | 126621 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 606 | 17 | 3 | 5 | 4.4 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNCC(N)=O)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL348594 | 126621 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 606 | 17 | 3 | 5 | 4.4 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNCC(N)=O)C1 | 10.1016/0960-894X(95)00080-D | |||
9869033 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL290364 | 107200 | 5 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
71449177 | 86437 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 682 | 17 | 6 | 6 | 2.8 | CC(=O)N[C@H](C(=O)NCCCC[C@H](NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
CHEMBL2115161 | 86437 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 682 | 17 | 6 | 6 | 2.8 | CC(=O)N[C@H](C(=O)NCCCC[C@H](NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
71456198 | 85350 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 565 | 8 | 2 | 6 | 4.7 | COc1cc(C(=O)N(C)c2cc(C(=O)N[C@@H]3CCCCNC3=O)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL2112209 | 85350 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 565 | 8 | 2 | 6 | 4.7 | COc1cc(C(=O)N(C)c2cc(C(=O)N[C@@H]3CCCCNC3=O)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
44299583 | 108447 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 473 | 7 | 1 | 2 | 5.9 | NC(COCc1cc(Br)cc(Br)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL299275 | 108447 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 473 | 7 | 1 | 2 | 5.9 | NC(COCc1cc(Br)cc(Br)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
19968650 | 176144 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm980376b | |||
CHEMBL442028 | 176144 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 1 | 2 | 4.9 | NC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm980376b | |||
44319222 | 112920 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 657 | 10 | 1 | 6 | 5.9 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL313546 | 112920 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 657 | 10 | 1 | 6 | 5.9 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44326280 | 104854 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 297 | 5 | 1 | 2 | 4.5 | Cc1cc(COC[C@@H](N)c2ccccc2)cc(C(C)(C)C)c1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL273302 | 104854 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 297 | 5 | 1 | 2 | 4.5 | Cc1cc(COC[C@@H](N)c2ccccc2)cc(C(C)(C)C)c1 | 10.1016/0960-894X(95)00476-A | |||
49799942 | 17318 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 411 | 4 | 0 | 4 | 4.7 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3ccccc3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL1169534 | 17318 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 411 | 4 | 0 | 4 | 4.7 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3ccccc3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
44294194 | 183609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 430 | 4 | 2 | 2 | 4.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1(c2ccccc2)CCNCC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL46103 | 183609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 430 | 4 | 2 | 2 | 4.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1(c2ccccc2)CCNCC1 | 10.1016/s0960-894x(02)00249-4 | |||
24783421 | 128854 | 0 | None | - | 0 | Mongolian jird | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596463 | 128854 | 0 | None | - | 0 | Mongolian jird | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
22850669 | 209765 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL63109 | 209765 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
22850669 | 209765 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL63109 | 209765 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
44289169 | 108265 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL297883 | 108265 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
44358649 | 35562 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 631 | 9 | 1 | 3 | 7.5 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(C(c1ccccc1)c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL137868 | 35562 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 631 | 9 | 1 | 3 | 7.5 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(C(c1ccccc1)c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358611 | 35883 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 580 | 8 | 2 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(O)(c2ccccc2)CC1 | 10.1021/jm000986n | |||
CHEMBL138130 | 35883 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 580 | 8 | 2 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(O)(c2ccccc2)CC1 | 10.1021/jm000986n | |||
44358673 | 38237 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 10 | 1 | 5 | 4.8 | COc1ccccc1C(CNC(=O)Cc1cccc(OC(C)C)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL140303 | 38237 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 10 | 1 | 5 | 4.8 | COc1ccccc1C(CNC(=O)Cc1cccc(OC(C)C)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
44289169 | 108265 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL297883 | 108265 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
44297728 | 107540 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 751 | 8 | 1 | 5 | 6.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)NC(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL292874 | 107540 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 751 | 8 | 1 | 5 | 6.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)NC(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44294416 | 190746 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 7 | 0 | 5 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCN(C)C)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
74972686 | 190746 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 7 | 0 | 5 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCN(C)C)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL48173 | 190746 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 7 | 0 | 5 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCN(C)C)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL406442 | 219387 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(c1ccccc1)c1ccccc1)C(N)=O | 10.1021/jm00037a009 | |||||
44458825 | 18762 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.8 | CCN1/C(=C\C=C2/CCC[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
54428149 | 18762 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.8 | CCN1/C(=C\C=C2/CCC[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1183194 | 18762 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.8 | CCN1/C(=C\C=C2/CCC[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL283990 | 18762 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.8 | CCN1/C(=C\C=C2/CCC[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
132961 | 148880 | 15 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 561 | 7 | 1 | 4 | 6.6 | COc1ccccc1[C@H](C)C(=O)N1C[C@H]2[C@@H](C1)[C@](O)(c1ccccc1OC)CCC2(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80178-5 | |||
CHEMBL38824 | 148880 | 15 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 561 | 7 | 1 | 4 | 6.6 | COc1ccccc1[C@H](C)C(=O)N1C[C@H]2[C@@H](C1)[C@](O)(c1ccccc1OC)CCC2(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80178-5 | |||
10364942 | 100129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 6 | 2 | 4 | 5.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)c1 | 10.1021/jm00035a006 | |||
CHEMBL24549 | 100129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 6 | 2 | 4 | 5.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)c1 | 10.1021/jm00035a006 | |||
71456210 | 85433 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 293 | 2 | 1 | 2 | 4.1 | c1ccc([C@H]2COC3(CCCN[C@H]3c3ccccc3)C2)cc1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL2112367 | 85433 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 293 | 2 | 1 | 2 | 4.1 | c1ccc([C@H]2COC3(CCCN[C@H]3c3ccccc3)C2)cc1 | 10.1016/s0960-894x(02)00509-7 | |||
10364942 | 100129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 6 | 2 | 4 | 5.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)c1 | 10.1021/jm00066a015 | |||
CHEMBL24549 | 100129 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 6 | 2 | 4 | 5.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)c1 | 10.1021/jm00066a015 | |||
49863733 | 22104 | 0 | None | 2 | 4 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
CHEMBL1214026 | 22104 | 0 | None | 2 | 4 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
44326290 | 214182 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 271 | 6 | 1 | 3 | 3.2 | COc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL93909 | 214182 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 271 | 6 | 1 | 3 | 3.2 | COc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
44288789 | 108153 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccc(Cl)cc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL297134 | 108153 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccc(Cl)cc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
44386105 | 138708 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 621 | 10 | 1 | 4 | 6.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL369498 | 138708 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 621 | 10 | 1 | 4 | 6.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
10429546 | 105833 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.2 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL280422 | 105833 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.2 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
46227361 | 209362 | 0 | None | -85 | 4 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611925 | 209362 | 0 | None | -85 | 4 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44289257 | 107126 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 435 | 6 | 1 | 3 | 5.2 | O=C(c1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL289573 | 107126 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 435 | 6 | 1 | 3 | 5.2 | O=C(c1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
44289257 | 107126 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 435 | 6 | 1 | 3 | 5.2 | O=C(c1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL289573 | 107126 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 435 | 6 | 1 | 3 | 5.2 | O=C(c1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
44288789 | 108153 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccc(Cl)cc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL297134 | 108153 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1ccc(Cl)cc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL2369603 | 216415 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
44306341 | 210524 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 499 | 9 | 2 | 4 | 2.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)Cc1ccccc1 | 10.1021/jm00039a022 | |||
CHEMBL67843 | 210524 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 499 | 9 | 2 | 4 | 2.6 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)Cc1ccccc1 | 10.1021/jm00039a022 | |||
10389745 | 107279 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.6 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL291074 | 107279 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.6 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
76318227 | 112581 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 459 | 7 | 1 | 2 | 6.7 | CCNC1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126964 | 112581 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 459 | 7 | 1 | 2 | 6.7 | CCNC1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
11612528 | 112592 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 471 | 6 | 0 | 2 | 6.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126974 | 112592 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 471 | 6 | 0 | 2 | 6.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
44334112 | 11812 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 513 | 6 | 1 | 3 | 7.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc3ccccc3c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL105201 | 11812 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 513 | 6 | 1 | 3 | 7.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc3ccccc3c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
44333950 | 115018 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 5.9 | COc1ccc(C[C@@H]2C[C@@H](NCc3ccnc4ccccc34)CCN2C(=O)c2cc(C)cc(C)c2)cc1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL319700 | 115018 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 5.9 | COc1ccc(C[C@@H]2C[C@@H](NCc3ccnc4ccccc34)CCN2C(=O)c2cc(C)cc(C)c2)cc1 | 10.1016/S0960-894X(96)00563-X | |||
44276728 | 174821 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 417 | 4 | 0 | 2 | 6.1 | CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL432279 | 174821 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 417 | 4 | 0 | 2 | 6.1 | CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
44299875 | 201567 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL53846 | 201567 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
44274167 | 90225 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 6 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3c(Cl)cc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21991 | 90225 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 6 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3c(Cl)cc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
44276728 | 174821 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 417 | 4 | 0 | 2 | 6.1 | CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL432279 | 174821 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 417 | 4 | 0 | 2 | 6.1 | CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
56678621 | 73219 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 467 | 6 | 0 | 2 | 6.9 | O=C1CCN(Cc2ccccc2-c2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817883 | 73219 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 467 | 6 | 0 | 2 | 6.9 | O=C1CCN(Cc2ccccc2-c2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852017 | 73219 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 467 | 6 | 0 | 2 | 6.9 | O=C1CCN(Cc2ccccc2-c2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
44306004 | 20106 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 539 | 13 | 4 | 4 | 3.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCCCN)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL1192152 | 20106 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 539 | 13 | 4 | 4 | 3.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCCCN)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL543338 | 20106 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 539 | 13 | 4 | 4 | 3.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCCCN)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44306694 | 107581 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1F)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL293164 | 107581 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1F)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44306354 | 209788 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 513 | 10 | 2 | 4 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)CCc1ccccc1 | 10.1021/jm00039a022 | |||
CHEMBL63249 | 209788 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 513 | 10 | 2 | 4 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)CCc1ccccc1 | 10.1021/jm00039a022 | |||
44312257 | 109687 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 5.6 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL306065 | 109687 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 5.6 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
44358602 | 34082 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 8 | 0 | 3 | 6.9 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL136734 | 34082 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 541 | 8 | 0 | 3 | 6.9 | CN(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358596 | 36039 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 591 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2ccccc12)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138269 | 36039 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 591 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2ccccc12)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
22293565 | 86479 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115449 | 86479 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
44303850 | 107846 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL294798 | 107846 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
44303793 | 206900 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 709 | 13 | 3 | 9 | 3.6 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N1Cc2ccccc2CC1C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL59615 | 206900 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 709 | 13 | 3 | 9 | 3.6 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N1Cc2ccccc2CC1C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
68932793 | 131574 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 599 | 5 | 1 | 4 | 4.7 | CN(C(=O)c1ccc(C(F)(F)F)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
CHEMBL3642173 | 131574 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 599 | 5 | 1 | 4 | 4.7 | CN(C(=O)c1ccc(C(F)(F)F)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
44337795 | 115352 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 593 | 9 | 1 | 5 | 5.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)N(C)C(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL320308 | 115352 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 593 | 9 | 1 | 5 | 5.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)N(C)C(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
9978999 | 12256 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 411 | 4 | 2 | 3 | 5.1 | Cc1cc2c(-c3ccccc3)c(NC(=O)NCc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL107618 | 12256 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 411 | 4 | 2 | 3 | 5.1 | Cc1cc2c(-c3ccccc3)c(NC(=O)NCc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
44324710 | 119126 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 592 | 14 | 2 | 4 | 5.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNC(C)=O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL329416 | 119126 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 592 | 14 | 2 | 4 | 5.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNC(C)=O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44358435 | 35491 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 599 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc2c(c1)OCCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL137792 | 35491 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 599 | 7 | 1 | 5 | 5.8 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc2c(c1)OCCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44381056 | 64384 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 322 | 5 | 1 | 3 | 3.6 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL166816 | 64384 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 322 | 5 | 1 | 3 | 3.6 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
44294376 | 18824 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.1 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCC(=O)O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
53927094 | 18824 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.1 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCC(=O)O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183513 | 18824 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.1 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCC(=O)O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL301946 | 18824 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.1 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCC(=O)O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
44294476 | 192987 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 6.5 | CC(NC(=O)[C@@](C)(Cc1cc2ccccc2[nH]1)NC(=O)OC(c1ccccc1)C(C)C)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
CHEMBL48731 | 192987 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 6.5 | CC(NC(=O)[C@@](C)(Cc1cc2ccccc2[nH]1)NC(=O)OC(c1ccccc1)C(C)C)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
132961 | 148880 | 15 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 561 | 7 | 1 | 4 | 6.6 | COc1ccccc1[C@H](C)C(=O)N1C[C@H]2[C@@H](C1)[C@](O)(c1ccccc1OC)CCC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL38824 | 148880 | 15 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 561 | 7 | 1 | 4 | 6.6 | COc1ccccc1[C@H](C)C(=O)N1C[C@H]2[C@@H](C1)[C@](O)(c1ccccc1OC)CCC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL264353 | 217397 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1c2ccccc2-c2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
44346199 | 21019 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL119947 | 21019 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL2369630 | 216424 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
44358834 | 37355 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 525 | 9 | 3 | 5 | 6.0 | COc1ccc2oc(COC(=O)N[C@](C)(Cc3c[nH]c4ccccc34)C(=O)N[C@@H](C)c3ccccc3)cc2c1 | 10.1021/jm00022a010 | |||
CHEMBL139375 | 37355 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 525 | 9 | 3 | 5 | 6.0 | COc1ccc2oc(COC(=O)N[C@](C)(Cc3c[nH]c4ccccc34)C(=O)N[C@@H](C)c3ccccc3)cc2c1 | 10.1021/jm00022a010 | |||
44346199 | 21019 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1021/jm9700171 | |||
CHEMBL119947 | 21019 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1021/jm9700171 | |||
44433782 | 152245 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 6.0 | CC(C)(C)OC(=O)N1C[C@H](c2ccccc2)[C@@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391441 | 152245 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 6.0 | CC(C)(C)OC(=O)N1C[C@H](c2ccccc2)[C@@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/j.bmcl.2007.08.028 | |||
9832198 | 113532 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144351 | 113532 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
16214865 | 180051 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 513 | 4 | 1 | 3 | 7.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cncc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL452531 | 180051 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 513 | 4 | 1 | 3 | 7.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cncc12 | 10.1016/j.bmc.2008.05.067 | |||
44346259 | 120894 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 425 | 7 | 3 | 2 | 4.4 | Cc1cc(C)cc(CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL332796 | 120894 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 425 | 7 | 3 | 2 | 4.4 | Cc1cc(C)cc(CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
44346259 | 120894 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 425 | 7 | 3 | 2 | 4.4 | Cc1cc(C)cc(CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL332796 | 120894 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 425 | 7 | 3 | 2 | 4.4 | Cc1cc(C)cc(CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm9700171 | |||
10767359 | 63276 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 2 | 4 | 3.7 | CCCCN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL163481 | 63276 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 2 | 4 | 3.7 | CCCCN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
44368082 | 51707 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.3 | Cn1nnc(CN[C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)n1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL152316 | 51707 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.3 | Cn1nnc(CN[C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)n1 | 10.1016/s0960-894x(97)10163-9 | |||
44287609 | 107137 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 503 | 6 | 0 | 5 | 5.4 | COc1ccccc1[C@H](SC)C(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL289666 | 107137 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 503 | 6 | 0 | 5 | 5.4 | COc1ccccc1[C@H](SC)C(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
44274316 | 172194 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 579 | 8 | 0 | 6 | 6.1 | COC(=O)Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(c3ccccc3OC)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL423836 | 172194 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 579 | 8 | 0 | 6 | 6.1 | COC(=O)Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(c3ccccc3OC)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
56666212 | 71416 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 442 | 7 | 1 | 4 | 4.9 | COc1ccc(NC(C)=O)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817896 | 71416 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 442 | 7 | 1 | 4 | 4.9 | COc1ccc(NC(C)=O)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
52941489 | 24503 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258623 | 24503 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL2112243 | 216009 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
21994365 | 32231 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 463 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1cc(C)cc(C)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL135028 | 32231 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 463 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1cc(C)cc(C)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358708 | 36562 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 665 | 8 | 0 | 3 | 8.6 | CC(C)C1CCN(C2CCN(C(CN(C)C(=O)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138714 | 36562 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 665 | 8 | 0 | 3 | 8.6 | CC(C)C1CCN(C2CCN(C(CN(C)C(=O)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1021/jm000986n | |||
44345148 | 17257 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 477 | 5 | 1 | 3 | 5.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NC(=O)c3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL116535 | 17257 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 477 | 5 | 1 | 3 | 5.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NC(=O)c3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
44458598 | 105624 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 489 | 6 | 1 | 4 | 5.7 | CC(=O)N[C@@H](Cc1csc2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL278849 | 105624 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 489 | 6 | 1 | 4 | 5.7 | CC(=O)N[C@@H](Cc1csc2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
9954221 | 22305 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 7 | 1 | 2 | 5.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCCc3ccccc3)C[C@H]2Cc2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL121852 | 22305 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 7 | 1 | 2 | 5.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCCc3ccccc3)C[C@H]2Cc2ccccc2)c1 | 10.1021/jm9700171 | |||
44359025 | 35909 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 485 | 9 | 3 | 4 | 5.3 | COc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
CHEMBL138150 | 35909 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 485 | 9 | 3 | 4 | 5.3 | COc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
44306435 | 103564 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 566 | 9 | 2 | 5 | 4.2 | CC(C)n1cc(C(=O)N2C[C@H](O)CC2C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00039a022 | |||
CHEMBL264821 | 103564 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 566 | 9 | 2 | 5 | 4.2 | CC(C)n1cc(C(=O)N2C[C@H](O)CC2C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00039a022 | |||
44368326 | 179405 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1ccccc1CO[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL449347 | 179405 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1ccccc1CO[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44299750 | 202448 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1ccc(C)c(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL55651 | 202448 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1ccc(C)c(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
10483816 | 197977 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL51893 | 197977 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
10407571 | 174736 | 10 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL431690 | 174736 | 10 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
19797480 | 128324 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL358589 | 128324 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
10409595 | 11561 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 5.0 | CN(Cc1ccccc1)C(=O)Nc1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104075 | 11561 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 5.0 | CN(Cc1ccccc1)C(=O)Nc1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44358473 | 38238 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 609 | 7 | 0 | 3 | 7.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1C(CN1CCC(N2CCCCC2)CC1)c1ccccc1 | 10.1021/jm000986n | |||
CHEMBL140304 | 38238 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 609 | 7 | 0 | 3 | 7.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1C(CN1CCC(N2CCCCC2)CC1)c1ccccc1 | 10.1021/jm000986n | |||
44358801 | 125747 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 495 | 7 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1CCc2ccccc2C1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL342386 | 125747 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 495 | 7 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1CCc2ccccc2C1)c1ccccc1 | 10.1021/jm00022a010 | |||
14986146 | 51360 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1Cc1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL152011 | 51360 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1Cc1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44297488 | 201887 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 558 | 9 | 1 | 6 | 3.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(C#N)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54996 | 201887 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 558 | 9 | 1 | 6 | 3.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(C#N)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44297487 | 202057 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Cl)c3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL55129 | 202057 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Cl)c3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10073370 | 66693 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 469 | 4 | 1 | 2 | 5.2 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1Cc1c[nH]c2ccccc12 | 10.1021/jm00006a011 | |||
CHEMBL173120 | 66693 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 469 | 4 | 1 | 2 | 5.2 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1Cc1c[nH]c2ccccc12 | 10.1021/jm00006a011 | |||
10045010 | 96966 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.2 | CC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23822 | 96966 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.2 | CC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
44299854 | 107440 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.4 | FC(F)(F)c1cc(CC[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL292237 | 107440 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.4 | FC(F)(F)c1cc(CC[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
10041814 | 105651 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm00035a006 | |||
CHEMBL279050 | 105651 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm00035a006 | |||
10064734 | 129741 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm0311487 | |||
CHEMBL360815 | 129741 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm0311487 | |||
10041814 | 105651 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm00066a015 | |||
CHEMBL279050 | 105651 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.4 | Cc1cc(C)cc(COC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm00066a015 | |||
1016 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
2561 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
2733526 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
5384 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
CHEMBL83 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
DB00675 | 10519 | 78 | None | -39 | 35 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
44297424 | 197766 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 9 | 1 | 5 | 3.8 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL51863 | 197766 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 9 | 1 | 5 | 3.8 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(F)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
2247 | 7293 | 81 | None | -117 | 42 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
249 | 7293 | 81 | None | -117 | 42 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
2603 | 7293 | 81 | None | -117 | 42 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
CHEMBL296419 | 7293 | 81 | None | -117 | 42 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
DB00637 | 7293 | 81 | None | -117 | 42 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
44358981 | 168451 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 546 | 10 | 4 | 4 | 5.5 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(NC(=O)CCl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL413122 | 168451 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 546 | 10 | 4 | 4 | 5.5 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(NC(=O)CCl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
44346319 | 120233 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 597 | 9 | 3 | 6 | 5.9 | O=C(NC1(C(=O)N[C@@H](Cc2ccc3ccccc3c2)c2nnnn2Cc2ccccc2)CCCCC1)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL331925 | 120233 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 597 | 9 | 3 | 6 | 5.9 | O=C(NC1(C(=O)N[C@@H](Cc2ccc3ccccc3c2)c2nnnn2Cc2ccccc2)CCCCC1)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
12096357 | 62975 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 10 | 2 | 4 | 4.8 | CC(=O)N(Cc1ccccc1Cl)C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1 | 10.1021/jm950616c | |||
CHEMBL162636 | 62975 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 10 | 2 | 4 | 4.8 | CC(=O)N(Cc1ccccc1Cl)C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1 | 10.1021/jm950616c | |||
44368158 | 128545 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 473 | 8 | 0 | 6 | 4.6 | CN(Cc1nnn(C)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL358932 | 128545 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 473 | 8 | 0 | 6 | 4.6 | CN(Cc1nnn(C)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
11518191 | 112590 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 457 | 7 | 1 | 2 | 6.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(NC3CC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126972 | 112590 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 457 | 7 | 1 | 2 | 6.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(NC3CC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
76314660 | 112595 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 445 | 6 | 1 | 2 | 6.3 | CNC1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126977 | 112595 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 445 | 6 | 1 | 2 | 6.3 | CNC1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
11489240 | 102065 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL25639 | 102065 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
10407571 | 174736 | 10 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
CHEMBL431690 | 174736 | 10 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
44321456 | 213471 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 8 | 1 | 3 | 5.5 | CCOc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL89652 | 213471 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 8 | 1 | 3 | 5.5 | CCOc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
71541469 | 94209 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 438 | 7 | 0 | 3 | 5.6 | CC(C)Cc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333634 | 94209 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 438 | 7 | 0 | 3 | 5.6 | CC(C)Cc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
44318658 | 111560 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 387 | 4 | 1 | 5 | 3.4 | COc1ccc(OC)c([C@H]2COCC3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL310896 | 111560 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 387 | 4 | 1 | 5 | 3.4 | COc1ccc(OC)c([C@H]2COCC3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 | 10.1016/s0960-894x(02)00506-1 | |||
44415540 | 148582 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 488 | 5 | 0 | 2 | 6.2 | CN(C)C(=O)N(C)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL386258 | 148582 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 488 | 5 | 0 | 2 | 6.2 | CN(C)C(=O)N(C)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
71583094 | 94993 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347692 | 94993 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
71452663 | 85317 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
CHEMBL2112070 | 85317 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
11743207 | 11586 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 5 | 0 | 4 | 4.8 | COc1ccccc1CN(C)C(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104165 | 11586 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 426 | 5 | 0 | 4 | 4.8 | COc1ccccc1CN(C)C(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
10342371 | 11716 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL104737 | 11716 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
44358710 | 36987 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 493 | 8 | 0 | 6 | 4.1 | COc1ccccc1CC(=O)N(C)CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139057 | 36987 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 493 | 8 | 0 | 6 | 4.1 | COc1ccccc1CC(=O)N(C)CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
10531050 | 127130 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL353093 | 127130 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 567 | 12 | 2 | 5 | 4.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(Cc2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
118722856 | 122968 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 323 | 6 | 2 | 4 | 2.1 | N#CNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL3358420 | 122968 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 323 | 6 | 2 | 4 | 2.1 | N#CNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
44321408 | 113799 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 7 | 1 | 2 | 5.6 | CCc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL315435 | 113799 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 7 | 1 | 2 | 5.6 | CCc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44321408 | 113799 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 7 | 1 | 2 | 5.6 | CCc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL315435 | 113799 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 7 | 1 | 2 | 5.6 | CCc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
15037920 | 52503 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 430 | 7 | 1 | 2 | 5.8 | Clc1ccccc1CCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL153042 | 52503 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 430 | 7 | 1 | 2 | 5.8 | Clc1ccccc1CCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
10531291 | 13345 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL108304 | 13345 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
44380707 | 127350 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL354564 | 127350 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 352 | 6 | 1 | 4 | 3.6 | COc1cccc([C@H]2[C@@H](NCc3ccccc3OC)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
136056467 | 195980 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 4 | 0 | 5 | 3.4 | CCn1c(/C=C/C=C2\SCCN2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
49824386 | 195980 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 4 | 0 | 5 | 3.4 | CCn1c(/C=C/C=C2\SCCN2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL51135 | 195980 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 4 | 0 | 5 | 3.4 | CCn1c(/C=C/C=C2\SCCN2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
44348660 | 124824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 389 | 0 | 1 | 4 | 4.1 | C#C[C@]1(O)CCC2C3CC[C@H]4Cc5nc6nccn6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL340394 | 124824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 389 | 0 | 1 | 4 | 4.1 | C#C[C@]1(O)CCC2C3CC[C@H]4Cc5nc6nccn6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
2812 | 11551 | 101 | None | -43 | 34 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
CHEMBL104 | 11551 | 101 | None | -43 | 34 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
44404006 | 139534 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 549 | 7 | 1 | 3 | 5.7 | NC(=O)C1(c2ccccc2)CCN(CC[C@@]2(c3ccc(Cl)c(Cl)c3)CCN(C(=O)c3ccccc3)C2)CC1 | 10.1021/jm058225d | |||
CHEMBL370013 | 139534 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 549 | 7 | 1 | 3 | 5.7 | NC(=O)C1(c2ccccc2)CCN(CC[C@@]2(c3ccc(Cl)c(Cl)c3)CCN(C(=O)c3ccccc3)C2)CC1 | 10.1021/jm058225d | |||
10439730 | 113534 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144353 | 113534 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 702 | 12 | 3 | 6 | 3.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44297705 | 197662 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1ccccc1CNC(COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL51849 | 197662 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1ccccc1CNC(COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12 | 10.1016/s0960-894x(98)00320-5 | |||
71450949 | 86324 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 5.6 | CSN1CC2(CCN(C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL2114103 | 86324 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 5.6 | CSN1CC2(CCN(C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
10055415 | 113533 | 0 | None | 15 | 3 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144352 | 113533 | 0 | None | 15 | 3 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
10344874 | 126928 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL351387 | 126928 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
44386231 | 68154 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 607 | 8 | 1 | 4 | 6.3 | COc1c(C)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1C | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL176951 | 68154 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 607 | 8 | 1 | 4 | 6.3 | COc1c(C)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1C | 10.1016/0960-894X(96)00148-5 | |||
15639102 | 121306 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 6.0 | c1ccc(CN[C@H]2C3CC4CCCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL333566 | 121306 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 6.0 | c1ccc(CN[C@H]2C3CC4CCCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
11433531 | 97903 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 618 | 7 | 1 | 3 | 9.4 | CC(C)(C)[Si](C)(C)OCc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL23982 | 97903 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 618 | 7 | 1 | 3 | 9.4 | CC(C)(C)[Si](C)(C)OCc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
9933653 | 105784 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 454 | 7 | 1 | 2 | 6.4 | OC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL28003 | 105784 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 454 | 7 | 1 | 2 | 6.4 | OC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
44299444 | 203968 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 346 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56811 | 203968 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 346 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
58993503 | 128866 | 0 | None | - | 0 | Mongolian jird | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 6.0 | COC(=O)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596475 | 128866 | 0 | None | - | 0 | Mongolian jird | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 6.0 | COC(=O)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
44297858 | 162544 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 589 | 11 | 2 | 5 | 5.4 | CS(=O)(=O)Nc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL405820 | 162544 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 589 | 11 | 2 | 5 | 5.4 | CS(=O)(=O)Nc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
24992986 | 191083 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 489 | 4 | 0 | 2 | 7.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL484133 | 191083 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 489 | 4 | 0 | 2 | 7.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
18654565 | 174708 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 698 | 17 | 0 | 5 | 7.3 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL431459 | 174708 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 698 | 17 | 0 | 5 | 7.3 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
10370818 | 169430 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 571 | 6 | 1 | 3 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL416983 | 169430 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 571 | 6 | 1 | 3 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
44297708 | 201749 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 587 | 10 | 1 | 5 | 5.5 | CS(=O)(=O)N1CC2(CCN(C[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54578 | 201749 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 587 | 10 | 1 | 5 | 5.5 | CS(=O)(=O)N1CC2(CCN(C[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10834930 | 128279 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 365 | 6 | 1 | 3 | 4.4 | FC(F)(F)Oc1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL358305 | 128279 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 365 | 6 | 1 | 3 | 4.4 | FC(F)(F)Oc1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
44213477 | 212523 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 309 | 2 | 1 | 3 | 3.6 | c1ccc(C2CCC3(OCCNC3c3ccccc3)OC2)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL82692 | 212523 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 309 | 2 | 1 | 3 | 3.6 | c1ccc(C2CCC3(OCCNC3c3ccccc3)OC2)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
10369316 | 94999 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 517 | 5 | 0 | 3 | 7.2 | CC(C)(C)OC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347702 | 94999 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 517 | 5 | 0 | 3 | 7.2 | CC(C)(C)OC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
44328401 | 119444 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 6.0 | c1ccc(CNC2C3CC4CCCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
CHEMBL330362 | 119444 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 6.0 | c1ccc(CNC2C3CC4CCCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
10835447 | 31507 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 411 | 4 | 0 | 4 | 4.7 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3ccccc3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL134415 | 31507 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 411 | 4 | 0 | 4 | 4.7 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3ccccc3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
71583093 | 95004 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 416 | 5 | 0 | 1 | 7.1 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347851 | 95004 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 416 | 5 | 0 | 1 | 7.1 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
15755313 | 108976 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 649 | 15 | 4 | 9 | 2.5 | CC(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C | 10.1021/jm00089a011 | |||
CHEMBL302844 | 108976 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 649 | 15 | 4 | 9 | 2.5 | CC(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C | 10.1021/jm00089a011 | |||
19797425 | 44191 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1C | 10.1021/jm00024a007 | |||
CHEMBL145500 | 44191 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1C | 10.1021/jm00024a007 | |||
CHEMBL64037 | 222631 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a011 | |||||
46227360 | 209361 | 0 | None | -151 | 4 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611924 | 209361 | 0 | None | -151 | 4 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44297680 | 107420 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL292156 | 107420 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL265155 | 217417 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CSCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm00037a009 | |||||
122182824 | 128869 | 0 | None | - | 0 | Mongolian jird | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 468 | 7 | 1 | 3 | 6.3 | CN(C)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596478 | 128869 | 0 | None | - | 0 | Mongolian jird | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 468 | 7 | 1 | 3 | 6.3 | CN(C)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
56681948 | 73244 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 436 | 6 | 0 | 4 | 5.1 | O=C1CCN(Cc2ccccc2[N+](=O)[O-])CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817882 | 73244 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 436 | 6 | 0 | 4 | 5.1 | O=C1CCN(Cc2ccccc2[N+](=O)[O-])CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852159 | 73244 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 436 | 6 | 0 | 4 | 5.1 | O=C1CCN(Cc2ccccc2[N+](=O)[O-])CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
44335466 | 11826 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 720 | 8 | 2 | 5 | 6.0 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Br)c(Br)s1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL105295 | 11826 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 720 | 8 | 2 | 5 | 6.0 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Br)c(Br)s1 | 10.1016/s0960-894x(01)00631-x | |||
44358783 | 37442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 483 | 8 | 3 | 3 | 5.9 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1C | 10.1021/jm00022a010 | |||
CHEMBL139471 | 37442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 483 | 8 | 3 | 3 | 5.9 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1C | 10.1021/jm00022a010 | |||
11192771 | 101111 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 607 | 8 | 1 | 3 | 8.5 | CN(Cc1ccccc1)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL25065 | 101111 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 607 | 8 | 1 | 3 | 8.5 | CN(Cc1ccccc1)Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
9985523 | 105937 | 0 | None | - | 5 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 572 | 17 | 2 | 6 | 6.2 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)C[C@@H]1OCc1ccccc1 | 10.1021/jm960281e | |||
CHEMBL281200 | 105937 | 0 | None | - | 5 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 572 | 17 | 2 | 6 | 6.2 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)C[C@@H]1OCc1ccccc1 | 10.1021/jm960281e | |||
24799546 | 94197 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 6.5 | CC(C)CN(CC(C)C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333622 | 94197 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 6.5 | CC(C)CN(CC(C)C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
58993452 | 128841 | 0 | None | - | 0 | Mongolian jird | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.8 | Cc1nnnn1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596450 | 128841 | 0 | None | - | 0 | Mongolian jird | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.8 | Cc1nnnn1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44458786 | 17925 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.9 | CCN1/C(=C\C=C2CC(C)[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1178356 | 17925 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.9 | CCN1/C(=C\C=C2CC(C)[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL23096 | 17925 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 438 | 3 | 0 | 3 | 6.9 | CCN1/C(=C\C=C2CC(C)[n+]3c2n(CC)c2cc4ccccc4cc23)Sc2ccccc21 | 10.1021/jm00085a015 | |||
44349033 | 23561 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 453 | 0 | 1 | 4 | 5.6 | CC#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL124532 | 23561 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 453 | 0 | 1 | 4 | 5.6 | CC#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
22869971 | 172047 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 430 | 3 | 1 | 2 | 4.9 | N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL42306 | 172047 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 430 | 3 | 1 | 2 | 4.9 | N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
9981979 | 105934 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1C(F)(F)F)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL281194 | 105934 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1C(F)(F)F)c1ccccc1 | 10.1021/jm00035a006 | |||
44318349 | 212844 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 357 | 3 | 1 | 4 | 3.4 | COc1cccc([C@H]2COCC3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL85414 | 212844 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 357 | 3 | 1 | 4 | 3.4 | COc1cccc([C@H]2COCC3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 | 10.1016/s0960-894x(02)00506-1 | |||
44277742 | 107551 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccccc1CO[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL29293 | 107551 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccccc1CO[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80349-2 | |||
44321457 | 174973 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
CHEMBL433336 | 174973 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
11633082 | 112579 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@H]1CC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126962 | 112579 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@H]1CC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
10650263 | 32859 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL135572 | 32859 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
10501444 | 108654 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL300722 | 108654 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
135890952 | 212876 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 406 | 4 | 2 | 6 | 3.4 | Oc1n[nH]c(CN2CCOC3(CCC(c4ccccc4)CO3)C2c2ccccc2)n1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL85674 | 212876 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 406 | 4 | 2 | 6 | 3.4 | Oc1n[nH]c(CN2CCOC3(CCC(c4ccccc4)CO3)C2c2ccccc2)n1 | 10.1016/s0960-894x(02)00506-1 | |||
11225834 | 105985 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 4 | 0 | 2 | 7.5 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL281491 | 105985 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 4 | 0 | 2 | 7.5 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
10364638 | 21430 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL120546 | 21430 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
10094248 | 11558 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 430 | 4 | 0 | 3 | 5.4 | Cc1ccccc1-c1c(C(=O)N(C)Cc2ccccc2Cl)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
CHEMBL104060 | 11558 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 430 | 4 | 0 | 3 | 5.4 | Cc1ccccc1-c1c(C(=O)N(C)Cc2ccccc2Cl)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
10006814 | 12014 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 518 | 4 | 0 | 3 | 6.5 | CN(Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00016a014 | |||
CHEMBL106326 | 12014 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 518 | 4 | 0 | 3 | 6.5 | CN(Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00016a014 | |||
44288548 | 108035 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cc4ccccc4cn3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL296213 | 108035 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cc4ccccc4cn3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
44288790 | 177133 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 472 | 4 | 1 | 2 | 5.1 | CC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL44474 | 177133 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 472 | 4 | 1 | 2 | 5.1 | CC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
21994270 | 33867 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 501 | 7 | 1 | 3 | 6.0 | Cc1cc(C)cc(CC(=O)NCC(c2ccc(Cl)c(Cl)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL136544 | 33867 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 501 | 7 | 1 | 3 | 6.0 | Cc1cc(C)cc(CC(=O)NCC(c2ccc(Cl)c(Cl)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
44312953 | 211337 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 682 | 17 | 6 | 6 | 2.8 | CC(=O)NC(C(=O)NCCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
CHEMBL72951 | 211337 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 682 | 17 | 6 | 6 | 2.8 | CC(=O)NC(C(=O)NCCCCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
44359088 | 125562 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 8 | 3 | 3 | 5.3 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL342044 | 125562 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 8 | 3 | 3 | 5.3 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)c1ccccc1 | 10.1021/jm00022a010 | |||
178025 | 125931 | 6 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 8 | 3 | 3 | 5.6 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
CHEMBL342924 | 125931 | 6 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 8 | 3 | 3 | 5.6 | Cc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1 | 10.1021/jm00022a010 | |||
44305927 | 107388 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 8 | 2 | 5 | 3.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cc2ccccc2s1 | 10.1021/jm00039a022 | |||
CHEMBL291868 | 107388 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 8 | 2 | 5 | 3.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cc2ccccc2s1 | 10.1021/jm00039a022 | |||
44359111 | 125669 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 8 | 4 | 4 | 4.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(N)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL342260 | 125669 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 8 | 4 | 4 | 4.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(N)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
10364638 | 21430 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNC2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL120546 | 21430 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNC2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44346320 | 120234 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.1 | CN(C(=O)Cc1ccccc1)[C@H](Cc1ccc2ccccc2c1)NC(=O)C1(NC(=O)c2c[nH]c3ccccc23)CCCCC1 | 10.1021/jm9700171 | |||
CHEMBL331926 | 120234 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.1 | CN(C(=O)Cc1ccccc1)[C@H](Cc1ccc2ccccc2c1)NC(=O)C1(NC(=O)c2c[nH]c3ccccc23)CCCCC1 | 10.1021/jm9700171 | |||
44321442 | 213032 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL86806 | 213032 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
44334098 | 11888 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 477 | 7 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CCc2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL105631 | 11888 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 477 | 7 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CCc2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
44321457 | 174973 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL433336 | 174973 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
44458983 | 106381 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 473 | 6 | 2 | 4 | 4.4 | CC(=O)N[C@@H](Cc1n[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00035a006 | |||
CHEMBL283989 | 106381 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 473 | 6 | 2 | 4 | 4.4 | CC(=O)N[C@@H](Cc1n[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00035a006 | |||
44458351 | 106166 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL282657 | 106166 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
44277478 | 174186 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1C | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL429610 | 174186 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1C | 10.1016/S0960-894X(00)80349-2 | |||
19797429 | 177230 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 428 | 7 | 0 | 4 | 5.4 | O=[N+]([O-])c1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL444872 | 177230 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 428 | 7 | 0 | 4 | 5.4 | O=[N+]([O-])c1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10745241 | 117308 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 549 | 8 | 3 | 4 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1N | 10.1021/jm970499g | |||
CHEMBL325116 | 117308 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 549 | 8 | 3 | 4 | 4.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1N | 10.1021/jm970499g | |||
CHEMBL2369606 | 216418 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
44338530 | 16129 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 332 | 6 | 1 | 3 | 3.1 | Fc1cc(F)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL111303 | 16129 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 332 | 6 | 1 | 3 | 3.1 | Fc1cc(F)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44322429 | 213043 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 480 | 5 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL86890 | 213043 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 480 | 5 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44322610 | 213424 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 462 | 5 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL89245 | 213424 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 462 | 5 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44346330 | 21339 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 522 | 9 | 4 | 3 | 4.5 | O=C(N[C@H]1CCCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL120441 | 21339 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 522 | 9 | 4 | 3 | 4.5 | O=C(N[C@H]1CCCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
18669055 | 11382 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 485 | 5 | 0 | 3 | 6.3 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC(C)(C)C)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL102811 | 11382 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 485 | 5 | 0 | 3 | 6.3 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC(C)(C)C)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
136180338 | 171965 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 502 | 10 | 2 | 5 | 5.7 | CCCN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL422862 | 171965 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 502 | 10 | 2 | 5 | 5.7 | CCCN(Cc1n[nH]c(O)n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
11757401 | 66720 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173231 | 66720 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL281971 | 217626 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm9800346 | |||||
44287803 | 106986 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 456 | 5 | 1 | 4 | 5.0 | COc1ccccc1CC(=N)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL288371 | 106986 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 456 | 5 | 1 | 4 | 5.0 | COc1ccccc1CC(=N)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
25176461 | 94178 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 404 | 6 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333604 | 94178 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 404 | 6 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
25176462 | 94179 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 4.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)nc(C2CC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333605 | 94179 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 4.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)nc(C2CC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
58993541 | 128887 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 540 | 8 | 0 | 3 | 8.0 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCN(Cc4ccccc4)CC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596496 | 128887 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 540 | 8 | 0 | 3 | 8.0 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCN(Cc4ccccc4)CC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
136043848 | 84726 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 5.8 | CN(Cc1n[nH]c(O)n1)C[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL209627 | 84726 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 5.8 | CN(Cc1n[nH]c(O)n1)C[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46884433 | 14695 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 581 | 5 | 0 | 2 | 7.9 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(F)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090286 | 14695 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 581 | 5 | 0 | 2 | 7.9 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(F)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
57565074 | 94997 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 6.3 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNCCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347696 | 94997 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 6.3 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCNCCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2112240 | 216006 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
44358495 | 122926 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 7 | 0 | 3 | 6.4 | CN(CC(c1ccccc1)N1CCN(C2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL335788 | 122926 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 7 | 0 | 3 | 6.4 | CN(CC(c1ccccc1)N1CCN(C2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
10722491 | 126813 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 615 | 12 | 2 | 5 | 5.4 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL350366 | 126813 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 615 | 12 | 2 | 5 | 5.4 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)c1ccccc1 | 10.1021/jm950616c | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL439019 | 220597 | 0 | None | 3 | 3 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
44294519 | 110286 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 610 | 6 | 1 | 4 | 7.2 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(C3CCC(=O)O3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085126 | 110286 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 610 | 6 | 1 | 4 | 7.2 | CC(C(=O)NC1(c2ccccc2)CCC(N2CCC(C3CCC(=O)O3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
44407467 | 80738 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 410 | 5 | 2 | 3 | 5.1 | FC(F)(F)Oc1ccc(Cl)c(CNC2CCC3CCC2(c2ccccc2)N3)c1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL202141 | 80738 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 410 | 5 | 2 | 3 | 5.1 | FC(F)(F)Oc1ccc(Cl)c(CNC2CCC3CCC2(c2ccccc2)N3)c1 | 10.1016/j.bmcl.2005.11.026 | |||
44415471 | 146338 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.0 | CN(CC(N)=O)[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL379707 | 146338 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.0 | CN(CC(N)=O)[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46830287 | 14762 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[n+]([O-])cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090648 | 14762 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[n+]([O-])cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
46881729 | 14711 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090421 | 14711 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
24752568 | 15684 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1097693 | 15684 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 490 | 4 | 1 | 3 | 5.0 | C[C@@H](O[C@H]1CN2C(=O)C(N)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.bmc.2010.07.034 | |||||
44358727 | 33610 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 7 | 0 | 3 | 6.4 | CN(CC(c1ccccc1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL136323 | 33610 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 555 | 7 | 0 | 3 | 6.4 | CN(CC(c1ccccc1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
44359071 | 172451 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc(F)ccc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL424480 | 172451 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc(F)ccc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
44177670 | 68036 | 0 | None | -1 | 4 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766206 | 68036 | 0 | None | -1 | 4 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44334108 | 11421 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 504 | 6 | 0 | 2 | 7.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL103085 | 11421 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 504 | 6 | 0 | 2 | 7.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
135767968 | 52144 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 386 | 8 | 2 | 5 | 3.9 | Cc1cc(Cl)cc(COC[C@H](c2ccccc2)N(C)Cc2n[nH]c(O)n2)c1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL152716 | 52144 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 386 | 8 | 2 | 5 | 3.9 | Cc1cc(Cl)cc(COC[C@H](c2ccccc2)N(C)Cc2n[nH]c(O)n2)c1 | 10.1016/s0960-894x(97)10163-9 | |||
10457416 | 21658 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL120781 | 21658 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
490428 | 126354 | 6 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL346154 | 126354 | 6 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
44299273 | 201593 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 402 | 10 | 2 | 3 | 4.1 | Cc1cc(C)cc(COCC(NCC(N)=O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL53901 | 201593 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 402 | 10 | 2 | 3 | 4.1 | Cc1cc(C)cc(COCC(NCC(N)=O)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
24782911 | 128867 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596476 | 128867 | 0 | None | - | 0 | Mongolian jird | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
16663280 | 104737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL272649 | 104737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
16663280 | 104737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL272649 | 104737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 475 | 4 | 0 | 2 | 6.1 | C[C@@H](O[C@H]1CN2C(=O)CC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
10744602 | 63155 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 523 | 10 | 2 | 4 | 4.1 | CC(=O)N(Cc1ccccc1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL163133 | 63155 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 523 | 10 | 2 | 4 | 4.1 | CC(=O)N(Cc1ccccc1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44274277 | 87850 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 551 | 7 | 1 | 4 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-n3cccc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21548 | 87850 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 551 | 7 | 1 | 4 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-n3cccc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
56681950 | 73239 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(OC)c1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817887 | 73239 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(OC)c1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852130 | 73239 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(OC)c1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
44415484 | 175717 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL438789 | 175717 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46884472 | 14767 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc[n+]([O-])c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090653 | 14767 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 5 | 0 | 3 | 6.4 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc[n+]([O-])c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52947646 | 24017 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256588 | 24017 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 620 | 7 | 1 | 3 | 7.5 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@@H](NCc4ccccc4)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
52948868 | 24020 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1256591 | 24020 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 559 | 5 | 1 | 3 | 6.5 | CC[C@]1(O)C[C@@H]2C(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)[C@@H]3[C@@H]2C1 | 10.1016/j.bmcl.2010.07.058 | |||
21994340 | 34794 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 623 | 7 | 0 | 3 | 7.7 | CN(CC(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL137255 | 34794 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 623 | 7 | 0 | 3 | 7.7 | CN(CC(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
11800372 | 125044 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 531 | 3 | 0 | 4 | 6.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL340931 | 125044 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 531 | 3 | 0 | 4 | 6.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL2370874 | 216718 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1016/S0960-894X(01)80229-8 | |||||
44359094 | 40372 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 511 | 8 | 3 | 4 | 6.5 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2s1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL142121 | 40372 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 511 | 8 | 3 | 4 | 6.5 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2s1)c1ccccc1 | 10.1021/jm00022a010 | |||
9927183 | 202384 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1021/jm9700171 | |||
CHEMBL55591 | 202384 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1021/jm9700171 | |||
136180337 | 128297 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 460 | 8 | 3 | 5 | 4.6 | Oc1n[nH]c(CN[C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)n1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL358437 | 128297 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 460 | 8 | 3 | 5 | 4.6 | Oc1n[nH]c(CN[C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)n1 | 10.1016/s0960-894x(97)10163-9 | |||
10834119 | 42405 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 351 | 5 | 1 | 2 | 5.1 | Cc1cc(COCC2(c3ccccc3)CCNCC2)cc(C(C)(C)C)c1 | 10.1021/jm980376b | |||
CHEMBL143974 | 42405 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 351 | 5 | 1 | 2 | 5.1 | Cc1cc(COCC2(c3ccccc3)CCNCC2)cc(C(C)(C)C)c1 | 10.1021/jm980376b | |||
CHEMBL405422 | 219340 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(C)(C)SC)C(N)=O | 10.1021/jm00037a009 | |||||
44294224 | 110284 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 526 | 5 | 1 | 2 | 7.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N2CCCCC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085124 | 110284 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 526 | 5 | 1 | 2 | 7.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N2CCCCC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
9887525 | 196604 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL51648 | 196604 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
44415392 | 148200 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 513 | 7 | 2 | 4 | 6.1 | CN(Cc1c[nH]c(O)n1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL384102 | 148200 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 513 | 7 | 2 | 4 | 6.1 | CN(Cc1c[nH]c(O)n1)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
24889113 | 14720 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090450 | 14720 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1204418 | 14720 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 571 | 5 | 0 | 4 | 6.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3COC(=O)C3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44358467 | 175020 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL433683 | 175020 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44328394 | 214479 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.3 | COc1ccccc1CNC1C2C3CCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL95561 | 214479 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 438 | 7 | 1 | 3 | 5.3 | COc1ccccc1CNC1C2C3CCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
44319084 | 20469 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 723 | 10 | 0 | 8 | 5.4 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL1194867 | 20469 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 723 | 10 | 0 | 8 | 5.4 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL553451 | 20469 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 723 | 10 | 0 | 8 | 5.4 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44319321 | 20476 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccncc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL1194933 | 20476 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccncc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL553554 | 20476 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccncc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a011 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a011 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a011 | |||
CHEMBL405209 | 219328 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1c2ccccc2-c2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
22293565 | 86402 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115004 | 86402 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 607 | 6 | 0 | 3 | 8.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
46881682 | 14869 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1091469 | 14869 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)C(C)(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
11654898 | 95005 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347852 | 95005 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
10369341 | 12526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 518 | 4 | 1 | 3 | 6.5 | Cc1ccccc1-c1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
CHEMBL107848 | 12526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 518 | 4 | 1 | 3 | 6.5 | Cc1ccccc1-c1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
9980171 | 16008 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 0 | 5 | 4.0 | COc1ccccc1CN(C)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL110679 | 16008 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 0 | 5 | 4.0 | COc1ccccc1CN(C)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
10506929 | 63353 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)cc1 | 10.1021/jm950616c | |||
CHEMBL164175 | 63353 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)cc1 | 10.1021/jm950616c | |||
18407045 | 88892 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2nc(Cl)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21662 | 88892 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 521 | 6 | 1 | 4 | 6.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2nc(Cl)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL263852 | 217372 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(C)(C)C)C(N)=O | 10.1021/jm00037a009 | |||||
23025481 | 71414 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 430 | 7 | 0 | 5 | 4.8 | COc1ccc([N+](=O)[O-])cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817893 | 71414 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 430 | 7 | 0 | 5 | 4.8 | COc1ccc([N+](=O)[O-])cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
57400460 | 77726 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 444 | 4 | 1 | 2 | 5.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951616 | 77726 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 444 | 4 | 1 | 2 | 5.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.11.048 | |||
57398780 | 77727 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 5.3 | CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951618 | 77727 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 5.3 | CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
46881779 | 15222 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1093750 | 15222 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 505 | 4 | 1 | 3 | 5.5 | C[C@@H](O[C@H]1CN2C(=O)CC(C)(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
11561036 | 95006 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347853 | 95006 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
11539564 | 95007 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347854 | 95007 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL389651 | 219208 | 0 | None | 6 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
10369844 | 106114 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 534 | 7 | 2 | 3 | 6.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL282290 | 106114 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 534 | 7 | 2 | 3 | 6.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
24800578 | 94198 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 419 | 6 | 1 | 4 | 4.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)nc(N2CCCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333623 | 94198 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 419 | 6 | 1 | 4 | 4.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)nc(N2CCCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
44307417 | 209852 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 488 | 8 | 1 | 3 | 5.7 | NC(=O)CCCN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL63762 | 209852 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 488 | 8 | 1 | 3 | 5.7 | NC(=O)CCCN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
57397020 | 77731 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2CC[C@@H](C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951622 | 77731 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 583 | 5 | 1 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2CC[C@@H](C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmc.2011.11.048 | |||
44456847 | 104228 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 566 | 6 | 0 | 2 | 7.4 | C[C@@H](O[C@H]1CN2C(=O)N(Cc3ccccc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL270114 | 104228 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 566 | 6 | 0 | 2 | 7.4 | C[C@@H](O[C@H]1CN2C(=O)N(Cc3ccccc3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
44415436 | 86734 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | NC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212644 | 86734 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | NC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44415530 | 86906 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 460 | 5 | 2 | 2 | 5.5 | CNC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL213316 | 86906 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 460 | 5 | 2 | 2 | 5.5 | CNC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44415448 | 148218 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.0 | CN(CC(N)=O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL384157 | 148218 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 5.0 | CN(CC(N)=O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
46881729 | 14711 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1090421 | 14711 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)CC(O)[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
10414293 | 44227 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145535 | 44227 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
71449143 | 86295 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 611 | 5 | 2 | 3 | 6.7 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(Cl)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL2113740 | 86295 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 611 | 5 | 2 | 3 | 6.7 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N[C@@H]2CCCCNC2=O)ccc1-c1ccc(Cl)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
10603019 | 12016 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 564 | 11 | 1 | 5 | 4.7 | COc1ccccc1CN(CC(Cc1cccc2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL106334 | 12016 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 564 | 11 | 1 | 5 | 4.7 | COc1ccccc1CN(CC(Cc1cccc2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
10369653 | 103575 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 528 | 7 | 0 | 4 | 7.2 | Cc1nc(CN2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)cs1 | 10.1021/jm980376b | |||
CHEMBL264997 | 103575 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 528 | 7 | 0 | 4 | 7.2 | Cc1nc(CN2CCC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccccc3)CC2)cs1 | 10.1021/jm980376b | |||
10624372 | 210487 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 475 | 6 | 0 | 4 | 5.6 | COC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL67612 | 210487 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 475 | 6 | 0 | 4 | 5.6 | COC(=O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
44318640 | 212635 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 399 | 4 | 1 | 4 | 4.6 | COc1ccc(C(C)C)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL83716 | 212635 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 399 | 4 | 1 | 4 | 4.6 | COc1ccc(C(C)C)cc1[C@H]1COCC2(C1)OCCN[C@H]2c1ccc(F)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
44410155 | 146067 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 569 | 6 | 1 | 4 | 6.5 | O=S(=O)(c1ccccc1)C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL379152 | 146067 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 569 | 6 | 1 | 4 | 6.5 | O=S(=O)(c1ccccc1)C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
24782912 | 128865 | 0 | None | - | 0 | Mongolian jird | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596474 | 128865 | 0 | None | - | 0 | Mongolian jird | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44433800 | 153567 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392463 | 153567 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
21994327 | 33702 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 591 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2ccccc12)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL136411 | 33702 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 591 | 7 | 1 | 3 | 7.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc2ccccc12)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
10815815 | 126839 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 519 | 11 | 2 | 5 | 3.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N(C)C)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL350582 | 126839 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 519 | 11 | 2 | 5 | 3.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N(C)C)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL387670 | 219190 | 0 | None | 109 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061369n | |||||
44333964 | 11914 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 511 | 6 | 0 | 3 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC3CCCCC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL105763 | 11914 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 511 | 6 | 0 | 3 | 6.8 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC3CCCCC3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
10837611 | 39015 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CC(C)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL140982 | 39015 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CC(C)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
10669293 | 40218 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 373 | 5 | 1 | 2 | 4.6 | Cc1cc(Br)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL141994 | 40218 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 373 | 5 | 1 | 2 | 4.6 | Cc1cc(Br)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
44274362 | 175970 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2ccccn2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL440649 | 175970 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2ccccn2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL2372518 | 217046 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
2102 | 7972 | 21 | None | 2 | 2 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(01)00044-0 | |||
5311057 | 7972 | 21 | None | 2 | 2 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL441225 | 7972 | 21 | None | 2 | 2 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/s0960-894x(01)00044-0 | |||
44358767 | 33883 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 593 | 7 | 1 | 3 | 6.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)c(Cl)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL136559 | 33883 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 593 | 7 | 1 | 3 | 6.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)c(Cl)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358741 | 37855 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 491 | 7 | 0 | 5 | 4.7 | Cc1cc(C)cc(CC(=O)N(C)CC(c2cccc3c2OCO3)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL139967 | 37855 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 491 | 7 | 0 | 5 | 4.7 | Cc1cc(C)cc(CC(=O)N(C)CC(c2cccc3c2OCO3)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL2371977 | 216950 | 0 | None | 17 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
11705830 | 112591 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 489 | 9 | 0 | 3 | 6.3 | COCCN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126973 | 112591 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 489 | 9 | 0 | 3 | 6.3 | COCCN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
10318976 | 214070 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 403 | 5 | 1 | 2 | 5.5 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCN2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
CHEMBL93216 | 214070 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 403 | 5 | 1 | 2 | 5.5 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCN2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80585-0 | |||
44326306 | 119113 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 319 | 5 | 1 | 2 | 4.0 | Cc1cc(Br)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL329325 | 119113 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 319 | 5 | 1 | 2 | 4.0 | Cc1cc(Br)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
44321442 | 213032 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00092a009 | |||
CHEMBL86806 | 213032 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00092a009 | |||
24800743 | 94192 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 411 | 6 | 1 | 4 | 4.1 | CN(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCNCC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333617 | 94192 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 411 | 6 | 1 | 4 | 4.1 | CN(C)c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCNCC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
44433802 | 153569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392464 | 153569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@@H](c3nc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)no3)[C@H](c3ccc(F)cc3C)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44335376 | 11317 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 717 | 7 | 2 | 4 | 6.3 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Br)c(Br)s1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL102376 | 11317 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 717 | 7 | 2 | 4 | 6.3 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Br)c(Br)s1 | 10.1016/s0960-894x(01)00631-x | |||
44370369 | 55678 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 12 | 1 | 3 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL155976 | 55678 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 12 | 1 | 3 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
44288951 | 107258 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 5 | 2 | 2 | 5.6 | CC(C)NC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL290926 | 107258 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 5 | 2 | 2 | 5.6 | CC(C)NC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
19797419 | 172039 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL423019 | 172039 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44380708 | 64348 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 356 | 5 | 1 | 3 | 4.3 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1c1cccc(Cl)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL166610 | 64348 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 356 | 5 | 1 | 3 | 4.3 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1c1cccc(Cl)c1 | 10.1016/S0960-894X(01)80859-3 | |||
9329 | 10513 | 5 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
9894349 | 10513 | 5 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
CHEMBL339486 | 10513 | 5 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10.1021/jm990220r | |||
44277726 | 105886 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL280849 | 105886 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL413827 | 219867 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
44177145 | 202507 | 0 | None | -6 | 3 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1191 | 27 | 10 | 10 | 5.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL557188 | 202507 | 0 | None | -6 | 3 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1191 | 27 | 10 | 10 | 5.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
44410321 | 148022 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 443 | 4 | 1 | 2 | 6.6 | C[C@H](OC1CCC2CCC1(c1ccccc1)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL382988 | 148022 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 443 | 4 | 1 | 2 | 6.6 | C[C@H](OC1CCC2CCC1(c1ccccc1)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
58993596 | 128843 | 0 | None | - | 0 | Mongolian jird | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 6 | 2 | 5 | 3.7 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2nnn[nH]2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596452 | 128843 | 0 | None | - | 0 | Mongolian jird | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 6 | 2 | 5 | 3.7 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2nnn[nH]2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44324706 | 214045 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 696 | 16 | 0 | 4 | 7.9 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2cc(C)cc(C)c2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL93038 | 214045 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 696 | 16 | 0 | 4 | 7.9 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2cc(C)cc(C)c2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44348756 | 22340 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 0 | 1 | 4 | 5.6 | C[C@]12Cc3cn4c(nc3CC1CCC1C2CC[C@@]2(C)C1CC[C@]2(C)O)nc1ccccc14 | 10.1021/jm00080a025 | |||
CHEMBL122020 | 22340 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 0 | 1 | 4 | 5.6 | C[C@]12Cc3cn4c(nc3CC1CCC1C2CC[C@@]2(C)C1CC[C@]2(C)O)nc1ccccc14 | 10.1021/jm00080a025 | |||
10627355 | 126788 | 0 | None | - | 0 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
CHEMBL350151 | 126788 | 0 | None | - | 0 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
44297520 | 202862 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 1.9 | CS(=O)(=O)N1CC2(CCN(C(=O)C(N)COCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL56069 | 202862 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 1.9 | CS(=O)(=O)N1CC2(CCN(C(=O)C(N)COCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44294355 | 18014 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 3.7 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC(N)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
49824390 | 18014 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 3.7 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC(N)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1178897 | 18014 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 3.7 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC(N)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL48454 | 18014 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 3.7 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CC(N)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
12225557 | 127955 | 1 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL357717 | 127955 | 1 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(01)81197-5 | |||
156500036 | 193223 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 428 | 5 | 3 | 4 | 3.9 | Cc1c(C2(c3ccc(C(F)(F)F)c(C#N)c3)CC2)c[nH]c1C(=O)NC(C)c1nc[nH]n1 | 10.1021/acs.jmedchem.1c00173 | |||
CHEMBL4876457 | 193223 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 428 | 5 | 3 | 4 | 3.9 | Cc1c(C2(c3ccc(C(F)(F)F)c(C#N)c3)CC2)c[nH]c1C(=O)NC(C)c1nc[nH]n1 | 10.1021/acs.jmedchem.1c00173 | |||
136046099 | 17926 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 0 | 2 | 6.0 | CCn1c(/C=C/C=c2/c3cccc4cccc(c43)n2C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
49824391 | 17926 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 0 | 2 | 6.0 | CCn1c(/C=C/C=c2/c3cccc4cccc(c43)n2C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL1178358 | 17926 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 0 | 2 | 6.0 | CCn1c(/C=C/C=c2/c3cccc4cccc(c43)n2C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL23181 | 17926 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 0 | 2 | 6.0 | CCn1c(/C=C/C=c2/c3cccc4cccc(c43)n2C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
10456618 | 139013 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 454 | 4 | 1 | 2 | 5.3 | O=C1CC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL369692 | 139013 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 454 | 4 | 1 | 2 | 5.3 | O=C1CC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
10698161 | 11967 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 562 | 10 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL106083 | 11967 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 562 | 10 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
11363490 | 100831 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 474 | 4 | 1 | 2 | 6.9 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL24894 | 100831 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 474 | 4 | 1 | 2 | 6.9 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
44359054 | 38600 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 555 | 8 | 3 | 3 | 7.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1c2ccccc2cc2ccccc12)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL140659 | 38600 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 555 | 8 | 3 | 3 | 7.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1c2ccccc2cc2ccccc12)c1ccccc1 | 10.1021/jm00022a010 | |||
10556941 | 105990 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 738 | 21 | 2 | 7 | 7.7 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccc(F)cc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm9800346 | |||
CHEMBL281530 | 105990 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 738 | 21 | 2 | 7 | 7.7 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccc(F)cc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm9800346 | |||
44333561 | 11442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 488 | 6 | 1 | 4 | 5.7 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C#N)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL103221 | 11442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 488 | 6 | 1 | 4 | 5.7 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(C#N)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
21753665 | 206457 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 8 | 1 | 2 | 5.2 | CC(=O)NC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL59310 | 206457 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 8 | 1 | 2 | 5.2 | CC(=O)NC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
10811257 | 108604 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL300303 | 108604 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
16755279 | 181872 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 547 | 4 | 0 | 5 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL456875 | 181872 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 547 | 4 | 0 | 5 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccc(F)cc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL413827 | 219867 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
44277726 | 105886 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL280849 | 105886 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
10350454 | 113508 | 0 | None | 10 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144209 | 113508 | 0 | None | 10 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44312951 | 109979 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 668 | 16 | 6 | 6 | 2.4 | CC(=O)NC(C(=O)NCCCC(NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
CHEMBL308363 | 109979 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 668 | 16 | 6 | 6 | 2.4 | CC(=O)NC(C(=O)NCCCC(NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)[C@@H](C)O | 10.1021/jm00068a003 | |||
9831641 | 86472 | 5 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 672 | 8 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[S@+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
CHEMBL2115415 | 86472 | 5 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 672 | 8 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[S@+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
10071124 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL278351 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm9700171 | |||
10506376 | 62631 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 529 | 10 | 2 | 4 | 4.4 | CC(=O)N(CC1CCCCC1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL162330 | 62631 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 529 | 10 | 2 | 4 | 4.4 | CC(=O)N(CC1CCCCC1)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44304144 | 20208 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 597 | 15 | 4 | 8 | 1.8 | NC(=O)CC[C@H](N)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL1192961 | 20208 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 597 | 15 | 4 | 8 | 1.8 | NC(=O)CC[C@H](N)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL544284 | 20208 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 597 | 15 | 4 | 8 | 1.8 | NC(=O)CC[C@H](N)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
44288772 | 162384 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 413 | 6 | 1 | 3 | 4.7 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccncc3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL40455 | 162384 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 413 | 6 | 1 | 3 | 4.7 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccncc3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
44358416 | 34083 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 631 | 10 | 1 | 6 | 6.1 | COc1ccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c(OC)c1OC | 10.1021/jm000986n | |||
CHEMBL136735 | 34083 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 631 | 10 | 1 | 6 | 6.1 | COc1ccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c(OC)c1OC | 10.1021/jm000986n | |||
44383969 | 135824 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL367034 | 135824 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
10412224 | 93497 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccc(C(F)(F)F)cc1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL23184 | 93497 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccc(C(F)(F)F)cc1)c1ccccc1 | 10.1021/jm00035a006 | |||
44324845 | 176072 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 634 | 16 | 1 | 4 | 7.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C(C)C)C(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL441458 | 176072 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 634 | 16 | 1 | 4 | 7.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C(C)C)C(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00006a012 | |||
10071124 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL278351 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
10004190 | 136865 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL367711 | 136865 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
10071124 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
CHEMBL278351 | 105569 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
44294481 | 110285 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 486 | 5 | 1 | 2 | 6.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N(C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
CHEMBL3085125 | 110285 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 486 | 5 | 1 | 2 | 6.3 | CC(C(=O)N[C@]1(c2ccccc2)CC[C@H](N(C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00250-0 | |||
24799711 | 94207 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 6 | 0 | 4 | 4.4 | COc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333632 | 94207 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 6 | 0 | 4 | 4.4 | COc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
42639650 | 194974 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)CCC3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL499004 | 194974 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 8.1 | C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)CCC3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44358552 | 125963 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 539 | 8 | 0 | 5 | 5.7 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1021/jm000986n | |||
CHEMBL343150 | 125963 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 539 | 8 | 0 | 5 | 5.7 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1021/jm000986n | |||
44270411 | 18755 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 453 | 9 | 1 | 2 | 5.8 | C=CC[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL1183074 | 18755 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 453 | 9 | 1 | 2 | 5.8 | C=CC[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL278487 | 18755 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 453 | 9 | 1 | 2 | 5.8 | C=CC[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
44359096 | 35904 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 8 | 3 | 3 | 5.6 | Cc1cccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c1 | 10.1021/jm00022a010 | |||
CHEMBL138146 | 35904 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 8 | 3 | 3 | 5.6 | Cc1cccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c1 | 10.1021/jm00022a010 | |||
46227363 | 206444 | 0 | None | -28 | 4 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL592969 | 206444 | 0 | None | -28 | 4 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
44212281 | 137394 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1cccc(OC)c1C(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL368159 | 137394 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1cccc(OC)c1C(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
44346420 | 21077 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1021/jm9700171 | |||
CHEMBL119990 | 21077 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1021/jm9700171 | |||
10393324 | 127587 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 574 | 5 | 2 | 3 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)N(C(=O)Nc2ccccc2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL355643 | 127587 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 574 | 5 | 2 | 3 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)N(C(=O)Nc2ccccc2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
56675185 | 73221 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccc(C(F)(F)F)cc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817834 | 73221 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccc(C(F)(F)F)cc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852026 | 73221 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccc(C(F)(F)F)cc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
68870199 | 131572 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 535 | 5 | 0 | 3 | 5.8 | CC(=O)N1CCC(CN2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642171 | 131572 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 535 | 5 | 0 | 3 | 5.8 | CC(=O)N1CCC(CN2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
44348605 | 119874 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 415 | 0 | 1 | 4 | 5.2 | C[C@]12Cc3cn4c(nc3CC1CCC1C2CC[C@@]2(C)C1CC[C@@H]2O)nc1ccccc14 | 10.1021/jm00080a025 | |||
CHEMBL331346 | 119874 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 415 | 0 | 1 | 4 | 5.2 | C[C@]12Cc3cn4c(nc3CC1CCC1C2CC[C@@]2(C)C1CC[C@@H]2O)nc1ccccc14 | 10.1021/jm00080a025 | |||
44288892 | 108282 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 6 | 1 | 2 | 5.3 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccccc3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL297970 | 108282 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 6 | 1 | 2 | 5.3 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccccc3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
44289168 | 175860 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43977 | 175860 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL2112246 | 216012 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
71461705 | 86393 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 672 | 8 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[S@@+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
CHEMBL2114963 | 86393 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 672 | 8 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[S@@+]4[O-])(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
9914897 | 185837 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 15 | 4 | 4 | 5.0 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1ccccc1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
CHEMBL47146 | 185837 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 15 | 4 | 4 | 5.0 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1ccccc1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
21994362 | 36500 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 465 | 9 | 1 | 5 | 4.1 | COc1ccc(CC(=O)NCC(c2ccccc2OC)N2CCN(C3CCCCC3)CC2)cc1 | 10.1021/jm000986n | |||
CHEMBL138666 | 36500 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 465 | 9 | 1 | 5 | 4.1 | COc1ccc(CC(=O)NCC(c2ccccc2OC)N2CCN(C3CCCCC3)CC2)cc1 | 10.1021/jm000986n | |||
9914897 | 185837 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 15 | 4 | 4 | 5.0 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1ccccc1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1021/jm950892r | |||
CHEMBL47146 | 185837 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 15 | 4 | 4 | 5.0 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1ccccc1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1021/jm950892r | |||
44212688 | 161825 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 375 | 8 | 1 | 3 | 4.5 | COc1cc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40164 | 161825 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 375 | 8 | 1 | 3 | 4.5 | COc1cc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44212684 | 169758 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 389 | 8 | 0 | 3 | 4.9 | COc1cc(CN(C)C(=O)CC(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL417519 | 169758 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 389 | 8 | 0 | 3 | 4.9 | COc1cc(CN(C)C(=O)CC(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44287557 | 175475 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 6 | 1 | 1 | 5.8 | O=C(CC(c1ccccc1)c1ccccc1)NCc1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL436698 | 175475 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 6 | 1 | 1 | 5.8 | O=C(CC(c1ccccc1)c1ccccc1)NCc1cc(Cl)cc(Cl)c1 | 10.1016/S0960-894X(96)00280-6 | |||
15037919 | 126405 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 396 | 6 | 1 | 2 | 5.4 | Cc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL346633 | 126405 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 396 | 6 | 1 | 2 | 5.4 | Cc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44307409 | 109034 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 353 | 7 | 2 | 4 | 2.5 | COc1ccccc1CN[C@H]1CCCN(CC(N)=O)[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL303181 | 109034 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 353 | 7 | 2 | 4 | 2.5 | COc1ccccc1CN[C@H]1CCCN(CC(N)=O)[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
10458783 | 105392 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 504 | 5 | 2 | 3 | 6.4 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL277004 | 105392 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 504 | 5 | 2 | 3 | 6.4 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
44312219 | 109158 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 506 | 6 | 3 | 2 | 5.1 | O=C(NCc1ccccc1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL303868 | 109158 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 506 | 6 | 3 | 2 | 5.1 | O=C(NCc1ccccc1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
15639130 | 120292 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 5.7 | c1ccc(CN[C@H]2C3C4CCCC3CN(C4)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL332106 | 120292 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 5.7 | c1ccc(CN[C@H]2C3C4CCCC3CN(C4)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
44346524 | 120298 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 2 | 4.9 | Clc1cccc([C@H]2[C@@H](NCc3ccccc3Cl)C3CCN2CC3)c1 | 10.1021/jm9700171 | |||
CHEMBL332140 | 120298 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 2 | 4.9 | Clc1cccc([C@H]2[C@@H](NCc3ccccc3Cl)C3CCN2CC3)c1 | 10.1021/jm9700171 | |||
10484232 | 202208 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)cc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL55229 | 202208 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)cc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
22859118 | 174992 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 445 | 8 | 2 | 5 | 4.3 | FC(F)(F)c1cc(COC[C@@H](NCc2nn[nH]n2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL433539 | 174992 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 445 | 8 | 2 | 5 | 4.3 | FC(F)(F)c1cc(COC[C@@H](NCc2nn[nH]n2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(97)10163-9 | |||
44346420 | 21077 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
CHEMBL119990 | 21077 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
58993475 | 128853 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596462 | 128853 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
46884434 | 14697 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 593 | 6 | 1 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(CO)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090288 | 14697 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 593 | 6 | 1 | 3 | 7.3 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(CO)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44306252 | 108986 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 602 | 8 | 2 | 5 | 4.6 | Cc1ccc2cc(C[C@@H](NC(=O)C3C[C@@H](O)CN3C(=O)c3cn(C)c4ccccc34)C(=O)N(C)Cc3ccccc3)ccc2c1 | 10.1021/jm00039a022 | |||
CHEMBL302892 | 108986 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 602 | 8 | 2 | 5 | 4.6 | Cc1ccc2cc(C[C@@H](NC(=O)C3C[C@@H](O)CN3C(=O)c3cn(C)c4ccccc34)C(=O)N(C)Cc3ccccc3)ccc2c1 | 10.1021/jm00039a022 | |||
44306226 | 109019 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 9 | 3 | 3 | 4.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(C)(C)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL303116 | 109019 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 9 | 3 | 3 | 4.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(C)(C)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
10005824 | 12675 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 491 | 5 | 0 | 3 | 7.0 | Cn1c(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)c2ccccc2c1=O | 10.1021/jm00016a014 | |||
CHEMBL107959 | 12675 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 491 | 5 | 0 | 3 | 7.0 | Cn1c(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)c2ccccc2c1=O | 10.1021/jm00016a014 | |||
9868622 | 12969 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 455 | 5 | 1 | 4 | 5.5 | COc1ccccc1CN(C)C(=O)Nc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL108126 | 12969 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 455 | 5 | 1 | 4 | 5.5 | COc1ccccc1CN(C)C(=O)Nc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
9888665 | 128759 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL359206 | 128759 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44312256 | 211359 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 7 | 2 | 5 | 5.7 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL73097 | 211359 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 7 | 2 | 5 | 5.7 | CSN1CC2(CCN(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
44312888 | 103511 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 626 | 14 | 6 | 6 | 1.4 | C[C@@H](O)C(NC(=O)CC(NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(N)=O | 10.1021/jm00068a003 | |||
CHEMBL264384 | 103511 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 626 | 14 | 6 | 6 | 1.4 | C[C@@H](O)C(NC(=O)CC(NC(=O)c1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(N)=O | 10.1021/jm00068a003 | |||
44319340 | 212692 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 707 | 10 | 0 | 6 | 7.2 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCCCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL84055 | 212692 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 707 | 10 | 0 | 6 | 7.2 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCCCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44319250 | 113784 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 589 | 10 | 1 | 6 | 4.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL315322 | 113784 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 589 | 10 | 1 | 6 | 4.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
158365 | 195502 | 6 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 664 | 5 | 4 | 6 | 3.1 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@]1([C@]34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)c3ccccc3N[C@H]21 | 10.1021/np50111a008 | |||
CHEMBL504788 | 195502 | 6 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 664 | 5 | 4 | 6 | 3.1 | O=C1N[C@@H](Cc2ccccc2)C(=O)N2[C@H]1C[C@]1([C@]34C[C@H]5C(=O)N[C@@H](Cc6ccccc6)C(=O)N5[C@H]3Nc3ccccc34)c3ccccc3N[C@H]21 | 10.1021/np50111a008 | |||
44346524 | 120298 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 2 | 4.9 | Clc1cccc([C@H]2[C@@H](NCc3ccccc3Cl)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL332140 | 120298 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 2 | 4.9 | Clc1cccc([C@H]2[C@@H](NCc3ccccc3Cl)C3CCN2CC3)c1 | 10.1016/S0960-894X(01)80859-3 | |||
44328407 | 114084 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 5.7 | c1ccc(CNC2C3C4CCCC3CN(C4)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
CHEMBL317289 | 114084 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 6 | 1 | 2 | 5.7 | c1ccc(CNC2C3C4CCCC3CN(C4)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
CHEMBL406812 | 219400 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1Cc2ccccc2C1)C(N)=O | 10.1021/jm00037a009 | |||||
44344209 | 121327 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CCC(NCc3ccnc4ccccc34)CC2[C@@H](C)c2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL333726 | 121327 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CCC(NCc3ccnc4ccccc34)CC2[C@@H](C)c2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
44375297 | 63566 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL164361 | 63566 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
19003143 | 210637 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COCC(N)Cc2ccc3ccccc3c2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL68670 | 210637 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COCC(N)Cc2ccc3ccccc3c2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
10448006 | 210676 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 308 | 6 | 2 | 2 | 3.9 | Cc1cc(C)cc(COCC(N)Cc2c[nH]c3ccccc23)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL68934 | 210676 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 308 | 6 | 2 | 2 | 3.9 | Cc1cc(C)cc(COCC(N)Cc2c[nH]c3ccccc23)c1 | 10.1016/S0960-894X(00)80063-3 | |||
44321047 | 212960 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL86378 | 212960 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1Cc1ccccc1 | 10.1021/jm9700171 | |||
44346550 | 21460 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COC[C@@H](N)Cc2ccc3ccccc3c2)c1 | 10.1021/jm9700171 | |||
CHEMBL120589 | 21460 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 319 | 6 | 1 | 2 | 4.5 | Cc1cc(C)cc(COC[C@@H](N)Cc2ccc3ccccc3c2)c1 | 10.1021/jm9700171 | |||
44346476 | 120903 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 308 | 6 | 2 | 2 | 3.9 | Cc1cc(C)cc(COC[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm9700171 | |||
CHEMBL332843 | 120903 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 308 | 6 | 2 | 2 | 3.9 | Cc1cc(C)cc(COC[C@@H](N)Cc2c[nH]c3ccccc23)c1 | 10.1021/jm9700171 | |||
44287210 | 107144 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.6 | O=C(CC(c1ccccc1)c1ccccc1)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL289728 | 107144 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.6 | O=C(CC(c1ccccc1)c1ccccc1)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
54582278 | 67927 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 5 | 1 | 2 | 6.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)ccnc1CCl | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765497 | 67927 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 5 | 1 | 2 | 6.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)ccnc1CCl | 10.1016/j.bmc.2011.02.031 | |||
16755278 | 196765 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 533 | 4 | 1 | 5 | 6.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccc(F)cc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL517102 | 196765 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 533 | 4 | 1 | 5 | 6.1 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccc(F)cc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL302668 | 217692 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O)OCc1ccccc1 | 10.1021/jm00089a011 | |||||
44297648 | 199358 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 600 | 9 | 2 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CNCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL52139 | 199358 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 600 | 9 | 2 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CNCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL5286807 | 201136 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 381 | 2 | 1 | 3 | 4.4 | Fc1ccc([C@@H]2NCCO[C@@]23C[C@@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
44318406 | 176484 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2ccccc2C(F)(F)F)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL443799 | 176484 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2ccccc2C(F)(F)F)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
24782915 | 128857 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596466 | 128857 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44433795 | 95546 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2cncnc2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL236304 | 95546 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2cncnc2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
18709628 | 173587 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 515 | 12 | 2 | 5 | 4.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccccc1OC)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42845 | 173587 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 515 | 12 | 2 | 5 | 4.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccccc1OC)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
9873546 | 84812 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 566 | 8 | 1 | 2 | 7.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(c2ccccc2)CC1)c1ccc(F)cc1 | 10.1021/jm060439n | |||
CHEMBL209899 | 84812 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 566 | 8 | 1 | 2 | 7.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(c2ccccc2)CC1)c1ccc(F)cc1 | 10.1021/jm060439n | |||
44348667 | 121105 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL124542 | 121105 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL333069 | 121105 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
44288926 | 108260 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 591 | 6 | 1 | 3 | 6.8 | O=C(c1cc(Br)cc(Br)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL297833 | 108260 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 591 | 6 | 1 | 3 | 6.8 | O=C(c1cc(Br)cc(Br)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
104943 | 62160 | 39 | None | - | 3 | Mouse | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL16192 | 62160 | 39 | None | - | 3 | Mouse | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
25129133 | 195666 | 0 | None | -10 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL507340 | 195666 | 0 | None | -10 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44303794 | 107607 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 711 | 16 | 3 | 9 | 3.7 | CN(C(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL293355 | 107607 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 711 | 16 | 3 | 9 | 3.7 | CN(C(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
71699790 | 131561 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642160 | 131561 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
44381059 | 64608 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 356 | 5 | 1 | 3 | 4.3 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1c1cccc(Cl)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL167066 | 64608 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 356 | 5 | 1 | 3 | 4.3 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1c1cccc(Cl)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL2112246 | 216012 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
CHEMBL2372444 | 217024 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
10478708 | 214352 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 445 | 8 | 1 | 1 | 6.1 | O=C(NCCc1ccccc1)C1(Cc2ccccc2)CCc2ccc(Cc3ccccc3)cc21 | 10.1016/S0960-894X(01)80821-0 | |||
CHEMBL94883 | 214352 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 445 | 8 | 1 | 1 | 6.1 | O=C(NCCc1ccccc1)C1(Cc2ccccc2)CCc2ccc(Cc3ccccc3)cc21 | 10.1016/S0960-894X(01)80821-0 | |||
CHEMBL5273060 | 200525 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1264 | 38 | 15 | 16 | -2.1 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O | 10.1021/acs.jmedchem.6b01029 | |||
21994346 | 36998 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 435 | 8 | 1 | 4 | 4.0 | COc1ccccc1C(CNC(=O)Cc1ccccc1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139071 | 36998 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 435 | 8 | 1 | 4 | 4.0 | COc1ccccc1C(CNC(=O)Cc1ccccc1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
44312324 | 211463 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 534 | 7 | 2 | 2 | 5.8 | CCN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL73896 | 211463 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 534 | 7 | 2 | 2 | 5.8 | CCN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
15295988 | 67847 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 4 | 2 | 2 | 4.7 | O=C1CNC(Cc2c[nH]c3ccccc23)CN1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL176471 | 67847 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 4 | 2 | 2 | 4.7 | O=C1CNC(Cc2c[nH]c3ccccc23)CN1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
10477953 | 105711 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccc(Cl)cc1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL279500 | 105711 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccc(Cl)cc1)c1ccccc1 | 10.1021/jm00035a006 | |||
19797451 | 43581 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL145008 | 43581 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44307118 | 209789 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 474 | 4 | 1 | 3 | 4.5 | NC(=O)C(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL63257 | 209789 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 474 | 4 | 1 | 3 | 4.5 | NC(=O)C(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
24782656 | 128860 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 5.8 | Nc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596469 | 128860 | 0 | None | - | 0 | Mongolian jird | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 5.8 | Nc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44338639 | 12498 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COC[C@@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL107831 | 12498 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COC[C@@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44338532 | 14402 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 324 | 6 | 1 | 3 | 3.5 | Cc1cc(C)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL108822 | 14402 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 324 | 6 | 1 | 3 | 3.5 | Cc1cc(C)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44322735 | 112754 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 472 | 6 | 1 | 2 | 5.7 | Cc1cccc(CN(C(=O)CCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL313070 | 112754 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 472 | 6 | 1 | 2 | 5.7 | Cc1cccc(CN(C(=O)CCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
44322728 | 213448 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 6 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL89425 | 213448 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 6 | 1 | 3 | 5.5 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1cccc(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
9801487 | 213777 | 0 | None | 5 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL91418 | 213777 | 0 | None | 5 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
25129133 | 195666 | 0 | None | -10 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
CHEMBL507340 | 195666 | 0 | None | -10 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
44306034 | 109504 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 631 | 10 | 3 | 7 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(NS(C)(=O)=O)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL304897 | 109504 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 631 | 10 | 3 | 7 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(NS(C)(=O)=O)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL2369763 | 216460 | 9 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
10027061 | 21724 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL120844 | 21724 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44346175 | 19163 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.3 | Cc1cc(C)cc(C(=O)N[C@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3)[C@H](Cc3ccccc3)C2)c1 | 10.1021/jm9700171 | |||
CHEMBL118565 | 19163 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.3 | Cc1cc(C)cc(C(=O)N[C@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3)[C@H](Cc3ccccc3)C2)c1 | 10.1021/jm9700171 | |||
22293526 | 86482 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.4 | O=C(NC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115452 | 86482 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.4 | O=C(NC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
68932391 | 131566 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 545 | 5 | 0 | 4 | 4.7 | COc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)C[C@H]2c2ccc(Cl)c(Cl)c2)cc1 | nan | |||
CHEMBL3642165 | 131566 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 545 | 5 | 0 | 4 | 4.7 | COc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)C[C@H]2c2ccc(Cl)c(Cl)c2)cc1 | nan | |||
10459262 | 11654 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 7.2 | Cc1cc2c(-c3ccccc3)c(CNCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL104435 | 11654 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 7.2 | Cc1cc2c(-c3ccccc3)c(CNCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
44370954 | 175111 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 558 | 10 | 1 | 6 | 4.5 | COC(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL434272 | 175111 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 558 | 10 | 1 | 6 | 4.5 | COC(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
1122655 | 129876 | 24 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 421 | 6 | 1 | 6 | 4.7 | O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)Nc1cccc(Cl)c1 | 10.1021/jm0311487 | |||
CHEMBL361031 | 129876 | 24 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 421 | 6 | 1 | 6 | 4.7 | O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)Nc1cccc(Cl)c1 | 10.1021/jm0311487 | |||
21994363 | 126135 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 488 | 7 | 1 | 3 | 5.6 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1 | 10.1021/jm000986n | |||
CHEMBL344370 | 126135 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 488 | 7 | 1 | 3 | 5.6 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1 | 10.1021/jm000986n | |||
CHEMBL2112245 | 216011 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC1=O | 10.1021/jm000316h | |||||
44308931 | 211117 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@H](N)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL71553 | 211117 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@H](N)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL2372517 | 217045 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(c1ccccc1)c1ccccc1)C(N)=O | 10.1021/jm00037a009 | |||||
44298065 | 202480 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 553 | 9 | 1 | 5 | 3.9 | CS(=O)(=O)N1CCC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)C1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL55691 | 202480 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 553 | 9 | 1 | 5 | 3.9 | CS(=O)(=O)N1CCC2(CCN(C(=O)[C@H](COCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)C1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL62581 | 222624 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||||
10769264 | 15988 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 562 | 10 | 2 | 3 | 5.0 | CN(CCc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL110508 | 15988 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 562 | 10 | 2 | 3 | 5.0 | CN(CCc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
25129135 | 179376 | 0 | None | -1584 | 4 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
CHEMBL448998 | 179376 | 0 | None | -1584 | 4 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
44384678 | 68145 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 697 | 11 | 1 | 8 | 6.2 | CCOC(=O)Oc1c(OC)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1OC | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL176860 | 68145 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 697 | 11 | 1 | 8 | 6.2 | CCOC(=O)Oc1c(OC)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1OC | 10.1016/0960-894X(96)00148-5 | |||
19797431 | 44209 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL145514 | 44209 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44299814 | 174741 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 415 | 3 | 1 | 2 | 5.0 | O=C1CO[C@@H](/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccccc2)N1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL431725 | 174741 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 415 | 3 | 1 | 2 | 5.0 | O=C1CO[C@@H](/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccccc2)N1 | 10.1016/S0960-894X(01)80534-5 | |||
11409185 | 106199 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL282853 | 106199 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
11329897 | 98673 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 522 | 5 | 1 | 2 | 7.6 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CCl)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL24136 | 98673 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 522 | 5 | 1 | 2 | 7.6 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(CCl)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
10004190 | 136865 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL367711 | 136865 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 1 | 3 | 5.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
44287443 | 107048 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 528 | 9 | 0 | 5 | 4.9 | CN(C)CCCOc1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL288942 | 107048 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 528 | 9 | 0 | 5 | 4.9 | CN(C)CCCOc1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
16755255 | 195910 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 529 | 4 | 0 | 5 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL510547 | 195910 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 529 | 4 | 0 | 5 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
11642147 | 94991 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 7 | 0 | 2 | 7.9 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCN(Cc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347690 | 94991 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 7 | 0 | 2 | 7.9 | FC(F)(F)c1cc(COC[C@]2(c3ccccc3)CCCN(Cc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
44288927 | 175557 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 503 | 6 | 1 | 3 | 6.5 | O=C(c1cc(Cl)cc(Cl)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43744 | 175557 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 503 | 6 | 1 | 3 | 6.5 | O=C(c1cc(Cl)cc(Cl)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
44359109 | 38744 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(Cl)cc1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL140768 | 38744 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(Cl)cc1)c1ccccc1 | 10.1021/jm00022a010 | |||
44297563 | 201736 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NC(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54435 | 201736 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NC(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44415393 | 87153 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 500 | 7 | 2 | 3 | 5.4 | O=C1CC[C@@H](CN[C@H]2CC[C@@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)N1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL214435 | 87153 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 500 | 7 | 2 | 3 | 5.4 | O=C1CC[C@@H](CN[C@H]2CC[C@@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H]2c2ccccc2)N1 | 10.1016/j.bmcl.2006.06.035 | |||
15755298 | 205495 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 732 | 15 | 4 | 9 | 5.0 | CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL58245 | 205495 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 732 | 15 | 4 | 9 | 5.0 | CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
71699789 | 131560 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 529 | 4 | 0 | 3 | 5.0 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642159 | 131560 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 529 | 4 | 0 | 3 | 5.0 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL2112245 | 216011 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC1=O | 10.1021/jm000316h | |||||
44294394 | 18024 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 4.7 | CCn1c(/C=C/C=C2/N(CC(=O)N(C)C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
53838756 | 18024 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 4.7 | CCn1c(/C=C/C=C2/N(CC(=O)N(C)C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1178980 | 18024 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 4.7 | CCn1c(/C=C/C=C2/N(CC(=O)N(C)C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL52448 | 18024 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 4.7 | CCn1c(/C=C/C=C2/N(CC(=O)N(C)C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
44297753 | 169458 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 526 | 10 | 1 | 4 | 6.1 | COc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL417026 | 169458 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 526 | 10 | 1 | 4 | 6.1 | COc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
10318912 | 104267 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 402 | 4 | 0 | 1 | 7.0 | FC(F)(F)c1cc(CO[C@H]2CCCC[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL27026 | 104267 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 402 | 4 | 0 | 1 | 7.0 | FC(F)(F)c1cc(CO[C@H]2CCCC[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
10249652 | 136511 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL367423 | 136511 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
15295989 | 66454 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 441 | 4 | 2 | 1 | 5.3 | O=C1NC(Cc2c[nH]c3ccccc23)CN1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL172238 | 66454 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 441 | 4 | 2 | 1 | 5.3 | O=C1NC(Cc2c[nH]c3ccccc23)CN1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
44324746 | 214077 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 565 | 14 | 1 | 4 | 5.5 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCOC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL93251 | 214077 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 565 | 14 | 1 | 4 | 5.5 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCOC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44334185 | 11340 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 449 | 5 | 1 | 3 | 6.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2c2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL102525 | 11340 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 449 | 5 | 1 | 3 | 6.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2c2ccccc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
44346664 | 23325 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL123764 | 23325 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44334185 | 11340 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 449 | 5 | 1 | 3 | 6.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL102525 | 11340 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 449 | 5 | 1 | 3 | 6.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2c2ccccc2)c1 | 10.1021/jm9700171 | |||
44297466 | 108683 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)cc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL300896 | 108683 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccc(Cl)cc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44333727 | 115995 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 5.9 | COc1cccc(C[C@@H]2C[C@@H](NCc3ccnc4ccccc34)CCN2C(=O)c2cc(C)cc(C)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL321710 | 115995 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 5.9 | COc1cccc(C[C@@H]2C[C@@H](NCc3ccnc4ccccc34)CCN2C(=O)c2cc(C)cc(C)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
10627789 | 107354 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 630 | 18 | 3 | 7 | 5.3 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1O | 10.1021/jm9800346 | |||
CHEMBL29161 | 107354 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 630 | 18 | 3 | 7 | 5.3 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1O | 10.1021/jm9800346 | |||
24889458 | 15202 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 583 | 6 | 0 | 5 | 6.7 | CCc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093594 | 15202 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 583 | 6 | 0 | 5 | 6.7 | CCc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
10790827 | 126689 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 478 | 10 | 2 | 5 | 2.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCOCC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL349273 | 126689 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 478 | 10 | 2 | 5 | 2.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCOCC1)C(C)=O | 10.1021/jm950616c | |||
44306309 | 107771 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 622 | 8 | 2 | 5 | 4.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2cc(Cl)ccc2c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL294342 | 107771 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 622 | 8 | 2 | 5 | 4.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2cc(Cl)ccc2c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
10840510 | 172069 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 555 | 11 | 2 | 6 | 4.0 | COc1ccccc1CN(CC(CC1CNc2ccccc21)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL423254 | 172069 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 555 | 11 | 2 | 6 | 4.0 | COc1ccccc1CN(CC(CC1CNc2ccccc21)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
54581251 | 67925 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 4 | 1 | 2 | 6.7 | Cc1nc(Cl)cc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765495 | 67925 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 4 | 1 | 2 | 6.7 | Cc1nc(Cl)cc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
56681832 | 73252 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2cccc(C(F)(F)F)c2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817833 | 73252 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2cccc(C(F)(F)F)c2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852229 | 73252 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2cccc(C(F)(F)F)c2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
21994308 | 37217 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 8 | 1 | 4 | 5.1 | COc1ccccc1C(CNC(=O)Cc1ccccc1C(F)(F)F)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139256 | 37217 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 8 | 1 | 4 | 5.1 | COc1ccccc1C(CNC(=O)Cc1ccccc1C(F)(F)F)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
10506124 | 108037 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
CHEMBL296228 | 108037 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
44344995 | 103231 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2\CC[C@@H](NC(=O)c3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL262301 | 103231 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2\CC[C@@H](NC(=O)c3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
44290659 | 108310 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 654 | 8 | 1 | 7 | 5.7 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[C@H]4O)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
CHEMBL298247 | 108310 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 654 | 8 | 1 | 7 | 5.7 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[C@H]4O)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
CHEMBL264341 | 217393 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)/C(=C/c1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
CHEMBL269584 | 217578 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm00037a009 | |||||
44337703 | 117464 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 603 | 9 | 2 | 6 | 4.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1/C(=N/c1ccccc1[N+](=O)[O-])NC#N | 10.1021/jm970499g | |||
CHEMBL326001 | 117464 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 603 | 9 | 2 | 6 | 4.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1/C(=N/c1ccccc1[N+](=O)[O-])NC#N | 10.1021/jm970499g | |||
CHEMBL2369630 | 216424 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
44212285 | 130596 | 1 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 7 | 1 | 3 | 5.7 | NC(=O)C1(c2ccccc2)CCN(CCC2(c3ccc(Cl)c(Cl)c3)CCN(C(=O)c3ccccc3)C2)CC1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL362394 | 130596 | 1 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 7 | 1 | 3 | 5.7 | NC(=O)C1(c2ccccc2)CCN(CCC2(c3ccc(Cl)c(Cl)c3)CCN(C(=O)c3ccccc3)C2)CC1 | 10.1016/0960-894X(96)00148-5 | |||
44276738 | 103965 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 560 | 6 | 0 | 2 | 7.9 | O=C(c1ccccc1)N1CCCC(CCCN2CCC3(CCc4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL26831 | 103965 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 560 | 6 | 0 | 2 | 7.9 | O=C(c1ccccc1)N1CCCC(CCCN2CCC3(CCc4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
10045837 | 68151 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.6 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(Cl)cc(Cl)c1 | 10.1021/jm00006a011 | |||
CHEMBL176919 | 68151 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 388 | 4 | 1 | 3 | 4.6 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(Cl)cc(Cl)c1 | 10.1021/jm00006a011 | |||
CHEMBL2369605 | 216417 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm960281e | |||||
16755280 | 183577 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 3.9 | COc1ccccc1CNC(=O)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL460683 | 183577 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 3.9 | COc1ccccc1CNC(=O)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
54584234 | 67935 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 479 | 4 | 1 | 5 | 5.1 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nnnn12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765503 | 67935 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 479 | 4 | 1 | 5 | 5.1 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nnnn12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL2114443 | 216034 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)[C@@H]1CCc2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
CHEMBL5291459 | 201311 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCO[C@@]23CC[C@@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
9851741 | 86968 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 604 | 7 | 1 | 2 | 8.0 | C[C@H]1CN(CC[C@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccc(F)cc2)CC[C@@]12C=Cc1ccccc12 | 10.1021/jm060439n | |||
CHEMBL213601 | 86968 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 604 | 7 | 1 | 2 | 8.0 | C[C@H]1CN(CC[C@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccc(F)cc2)CC[C@@]12C=Cc1ccccc12 | 10.1021/jm060439n | |||
CHEMBL2112242 | 216008 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
10456592 | 12071 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 453 | 4 | 1 | 3 | 6.1 | Cc1cc(C)cc(CN(C)C(=O)Nc2c(-c3ccccc3)c3cc(C)c(C)cc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
CHEMBL106609 | 12071 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 453 | 4 | 1 | 3 | 6.1 | Cc1cc(C)cc(CN(C)C(=O)Nc2c(-c3ccccc3)c3cc(C)c(C)cc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
56657842 | 70016 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 839 | 7 | 6 | 7 | 4.2 | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)C2C(=O)[C@@H](Cc3c2[nH]c2ccccc32)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCC2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm000316h | |||
CHEMBL1790897 | 70016 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 839 | 7 | 6 | 7 | 4.2 | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)C2C(=O)[C@@H](Cc3c2[nH]c2ccccc32)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCC2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm000316h | |||
44359260 | 122263 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 523 | 8 | 3 | 3 | 6.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(Cl)c(Cl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL335106 | 122263 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 523 | 8 | 3 | 3 | 6.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(Cl)c(Cl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
10407571 | 174736 | 10 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL431690 | 174736 | 10 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
10047989 | 99272 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 424 | 7 | 2 | 5 | 4.4 | COc1ccccc1COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00035a006 | |||
CHEMBL24314 | 99272 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 424 | 7 | 2 | 5 | 4.4 | COc1ccccc1COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00035a006 | |||
56671766 | 73218 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 407 | 5 | 1 | 3 | 4.9 | O=C1CCN(Cc2ccccc2O)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817828 | 73218 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 407 | 5 | 1 | 3 | 4.9 | O=C1CCN(Cc2ccccc2O)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852010 | 73218 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 407 | 5 | 1 | 3 | 4.9 | O=C1CCN(Cc2ccccc2O)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
44303835 | 108543 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 494 | 11 | 1 | 3 | 5.7 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](CO)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL299887 | 108543 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 494 | 11 | 1 | 3 | 5.7 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](CO)C1 | 10.1016/S0960-894X(01)80747-2 | |||
21256636 | 37000 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 8 | 1 | 4 | 5.4 | COc1ccccc1C(CNC(=O)Cc1ccc(Cl)c(Cl)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139072 | 37000 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 8 | 1 | 4 | 5.4 | COc1ccccc1C(CNC(=O)Cc1ccc(Cl)c(Cl)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
10047989 | 99272 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 424 | 7 | 2 | 5 | 4.4 | COc1ccccc1COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00066a015 | |||
CHEMBL24314 | 99272 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 424 | 7 | 2 | 5 | 4.4 | COc1ccccc1COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00066a015 | |||
CHEMBL216813 | 216120 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1Cc2ccccc2C1)C(N)=O | 10.1021/jm00037a009 | |||||
44321430 | 113763 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00092a009 | |||
CHEMBL315176 | 113763 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1cccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00092a009 | |||
10811257 | 108604 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL300303 | 108604 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
44277705 | 108744 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL30139 | 108744 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
44306217 | 209821 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 538 | 8 | 3 | 4 | 3.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCC(O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL63471 | 209821 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 538 | 8 | 3 | 4 | 3.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCC(O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44334111 | 116584 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 6 | 1 | 3 | 7.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2cccc3ccccc23)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL323317 | 116584 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 6 | 1 | 3 | 7.0 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2cccc3ccccc23)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL2372521 | 217048 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1CCc2ccccc21)C1c2ccccc2-c2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
24801797 | 94202 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 6 | 0 | 5 | 4.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC(C#N)C3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333627 | 94202 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 6 | 0 | 5 | 4.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CCC(C#N)C3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
71541470 | 94210 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.5 | C/C=C/c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333635 | 94210 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.5 | C/C=C/c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
24801101 | 94217 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 402 | 5 | 1 | 3 | 4.7 | Fc1ccc(C2(COCc3cc(C(F)(F)F)cc(Cl)n3)CCNCC2)cc1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333642 | 94217 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 402 | 5 | 1 | 3 | 4.7 | Fc1ccc(C2(COCc3cc(C(F)(F)F)cc(Cl)n3)CCNCC2)cc1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL306072 | 217756 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
67233125 | 133221 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 564 | 4 | 1 | 3 | 5.8 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)Nc3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3651888 | 133221 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 564 | 4 | 1 | 3 | 5.8 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)Nc3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
71541575 | 94187 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 379 | 6 | 0 | 4 | 4.2 | CN1CCC(COCc2cc(C#N)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333612 | 94187 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 379 | 6 | 0 | 4 | 4.2 | CN1CCC(COCc2cc(C#N)cc(C3CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
44277705 | 108744 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL30139 | 108744 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 397 | 6 | 0 | 2 | 5.8 | Cc1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
10649948 | 13460 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 532 | 9 | 2 | 3 | 4.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1F | 10.1021/jm970499g | |||
CHEMBL108349 | 13460 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 532 | 9 | 2 | 3 | 4.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1F | 10.1021/jm970499g | |||
18654560 | 119087 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 668 | 16 | 0 | 4 | 7.3 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL329168 | 119087 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 668 | 16 | 0 | 4 | 7.3 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44349003 | 24762 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 443 | 1 | 1 | 4 | 6.0 | CC[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL126221 | 24762 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 443 | 1 | 1 | 4 | 6.0 | CC[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
10350454 | 113508 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144209 | 113508 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 815 | 18 | 4 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44458353 | 106380 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL283979 | 106380 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
10520658 | 105423 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm00024a007 | |||
CHEMBL277260 | 105423 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm00024a007 | |||
44337500 | 113966 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 604 | 9 | 2 | 4 | 6.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cc2ccccc2s1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL316515 | 113966 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 604 | 9 | 2 | 4 | 6.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cc2ccccc2s1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
44458328 | 106291 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL283356 | 106291 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
44286798 | 174211 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.6 | CN(CC(c1ccccc1)c1ccccc1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL42972 | 174211 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.6 | CN(CC(c1ccccc1)c1ccccc1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
10075002 | 11533 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 508 | 7 | 1 | 5 | 5.8 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL103851 | 11533 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 508 | 7 | 1 | 5 | 5.8 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
10027219 | 106358 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.1 | NC(=O)C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL283872 | 106358 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.1 | NC(=O)C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
24799364 | 94195 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 467 | 9 | 1 | 4 | 6.0 | CCC(CC)Nc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333620 | 94195 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 467 | 9 | 1 | 4 | 6.0 | CCC(CC)Nc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
9910432 | 140301 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 428 | 4 | 2 | 2 | 5.6 | FC(F)(F)c1cc(CNC2CCC3CCC2(c2ccccc2)N3)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.026 | |||
CHEMBL370816 | 140301 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 428 | 4 | 2 | 2 | 5.6 | FC(F)(F)c1cc(CNC2CCC3CCC2(c2ccccc2)N3)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.026 | |||
22724580 | 146946 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 429 | 4 | 1 | 2 | 6.1 | FC(F)(F)c1cc(COC2CCC3CCC2(c2ccccc2)N3)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL380351 | 146946 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 429 | 4 | 1 | 2 | 6.1 | FC(F)(F)c1cc(COC2CCC3CCC2(c2ccccc2)N3)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL5268460 | 200344 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1278 | 40 | 16 | 16 | -1.8 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@H]1CCc2ccccc21)C(=O)N[C@@H](CCSC)C(=O)O | 10.1021/acs.jmedchem.6b01029 | |||
CHEMBL5282996 | 200958 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1326 | 40 | 16 | 16 | -0.7 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCSC)C(=O)O | 10.1021/acs.jmedchem.6b01029 | |||
44358719 | 36622 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 573 | 7 | 1 | 3 | 6.5 | Cc1c(F)cccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138764 | 36622 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 573 | 7 | 1 | 3 | 6.5 | Cc1c(F)cccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44358742 | 37737 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 657 | 7 | 0 | 3 | 8.4 | CN(CC(c1cc(Cl)cc(Cl)c1Cl)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL139854 | 37737 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 657 | 7 | 0 | 3 | 8.4 | CN(CC(c1cc(Cl)cc(Cl)c1Cl)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
10603097 | 63266 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 568 | 11 | 2 | 6 | 4.0 | CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL163310 | 63266 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 568 | 11 | 2 | 6 | 4.0 | CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
10674548 | 64217 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 3.9 | CNC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL165510 | 64217 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 3.9 | CNC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44305544 | 209853 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 582 | 5 | 1 | 2 | 8.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(Cl)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL63785 | 209853 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 582 | 5 | 1 | 2 | 8.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(Cl)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
10457416 | 21658 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL120781 | 21658 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
10457416 | 21658 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL120781 | 21658 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 470 | 7 | 2 | 2 | 5.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
11225834 | 105985 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 502 | 4 | 0 | 2 | 7.5 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL281491 | 105985 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 502 | 4 | 0 | 2 | 7.5 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
10696382 | 128761 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 489 | 7 | 0 | 4 | 5.4 | COC(=O)CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL359214 | 128761 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 489 | 7 | 0 | 4 | 5.4 | COC(=O)CN1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL2115375 | 216045 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)[C@H]1CCc2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
56668399 | 73241 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(OC)c(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817886 | 73241 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(OC)c(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852139 | 73241 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(OC)c(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
10530699 | 126916 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 550 | 11 | 2 | 4 | 5.0 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CC=C(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL351253 | 126916 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 550 | 11 | 2 | 4 | 5.0 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CC=C(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
9831309 | 142042 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1021/jm058225d | |||
CHEMBL372587 | 142042 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1021/jm058225d | |||
153996 | 119445 | 2 | None | 3 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL330366 | 119445 | 2 | None | 3 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL539021 | 119445 | 2 | None | 3 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
153996 | 119445 | 2 | None | - | 3 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL330366 | 119445 | 2 | None | - | 3 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL539021 | 119445 | 2 | None | - | 3 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44338583 | 12568 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 5.2 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1F | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL107875 | 12568 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 5.2 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1F | 10.1016/s0960-894x(02)00563-2 | |||
44338346 | 12643 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COC[C@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL107941 | 12643 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COC[C@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44338587 | 14211 | 3 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COC[C@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL108667 | 14211 | 3 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COC[C@H](c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44359083 | 36172 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 473 | 8 | 3 | 3 | 5.4 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL138390 | 36172 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 473 | 8 | 3 | 3 | 5.4 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1F)c1ccccc1 | 10.1021/jm00022a010 | |||
57398781 | 77728 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 5.3 | CC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951619 | 77728 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 5.3 | CC(=O)N1CC[C@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.11.048 | |||
24888943 | 14719 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 571 | 5 | 0 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090438 | 14719 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 571 | 5 | 0 | 3 | 7.1 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
52941489 | 24503 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258623 | 24503 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 516 | 4 | 1 | 3 | 5.2 | C[C@@H](O[C@H]1CN2C(=O)C3CNCC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
18709650 | 172026 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 501 | 11 | 3 | 5 | 4.0 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(O)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42295 | 172026 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 501 | 11 | 3 | 5 | 4.0 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(O)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
9888665 | 128759 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL359206 | 128759 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10721128 | 63060 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 537 | 10 | 2 | 4 | 4.4 | CC(=O)N(Cc1ccccc1C)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL162977 | 63060 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 537 | 10 | 2 | 4 | 4.4 | CC(=O)N(Cc1ccccc1C)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
10769745 | 64269 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 591 | 10 | 2 | 4 | 5.1 | CC(=O)N(Cc1ccccc1C(F)(F)F)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL165949 | 64269 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 591 | 10 | 2 | 4 | 5.1 | CC(=O)N(Cc1ccccc1C(F)(F)F)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm9700171 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm9700171 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm9700171 | |||
44297434 | 201753 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 599 | 9 | 1 | 4 | 5.8 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CCCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54602 | 201753 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 599 | 9 | 1 | 4 | 5.8 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CCCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
44273822 | 82279 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 569 | 7 | 1 | 4 | 7.0 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(N3CCCCC3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL20430 | 82279 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 569 | 7 | 1 | 4 | 7.0 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(N3CCCCC3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL2372516 | 217044 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1c2ccccc2-c2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
44289862 | 107127 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 541 | 13 | 2 | 5 | 4.9 | COc1ccc(C(=O)CCC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL289600 | 107127 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 541 | 13 | 2 | 5 | 4.9 | COc1ccc(C(=O)CCC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
21994258 | 126181 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 577 | 7 | 1 | 3 | 6.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)c(F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL344646 | 126181 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 577 | 7 | 1 | 3 | 6.4 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(F)c(F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44328423 | 114148 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.7 | COc1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL317761 | 114148 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 5.7 | COc1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL426363 | 220124 | 0 | None | 26 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
58993517 | 128871 | 0 | None | - | 0 | Mongolian jird | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 469 | 8 | 1 | 3 | 6.6 | CCOc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596480 | 128871 | 0 | None | - | 0 | Mongolian jird | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 469 | 8 | 1 | 3 | 6.6 | CCOc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
44433794 | 174231 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2ccncn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL429798 | 174231 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 536 | 5 | 0 | 4 | 5.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)c2ccncn2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
9927183 | 202384 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1016/j.bmcl.2007.10.010 | |||
CHEMBL55591 | 202384 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1016/j.bmcl.2007.10.010 | |||
15214194 | 11887 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 552 | 4 | 0 | 3 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2cc(Cl)ccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL105629 | 11887 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 552 | 4 | 0 | 3 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2cc(Cl)ccc2c(=O)n1C | 10.1021/jm00016a014 | |||
10096063 | 115201 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 4 | 0 | 4 | 5.5 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(Cl)cc(Cl)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
CHEMBL319874 | 115201 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 4 | 0 | 4 | 5.5 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(Cl)cc(Cl)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
11757401 | 66720 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173231 | 66720 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
2089 | 9542 | 28 | None | - | 5 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3795 | 9542 | 28 | None | - | 5 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
5311311 | 9542 | 28 | None | - | 5 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL217406 | 9542 | 28 | None | - | 5 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
44415513 | 172547 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 446 | 5 | 2 | 2 | 5.2 | NC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL424709 | 172547 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 446 | 5 | 2 | 2 | 5.2 | NC(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44306327 | 19806 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 595 | 11 | 2 | 6 | 3.2 | CN(C)CCn1cc(C(=O)N2C[C@H](O)CC2C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00039a022 | |||
CHEMBL1189912 | 19806 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 595 | 11 | 2 | 6 | 3.2 | CN(C)CCn1cc(C(=O)N2C[C@H](O)CC2C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00039a022 | |||
CHEMBL539762 | 19806 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 595 | 11 | 2 | 6 | 3.2 | CN(C)CCn1cc(C(=O)N2C[C@H](O)CC2C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)c2ccccc21 | 10.1021/jm00039a022 | |||
44306196 | 107511 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 605 | 9 | 2 | 7 | 3.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL292715 | 107511 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 605 | 9 | 2 | 7 | 3.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44306107 | 109612 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 606 | 8 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cccc(C(F)(F)F)c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL305547 | 109612 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 606 | 8 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cccc(C(F)(F)F)c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
18709663 | 172881 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 527 | 12 | 2 | 5 | 4.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(C(C)=O)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL42597 | 172881 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 527 | 12 | 2 | 5 | 4.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)COc1ccc(C(C)=O)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
44370340 | 126325 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 640 | 17 | 3 | 5 | 5.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCNCC(N)=O)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL345866 | 126325 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 640 | 17 | 3 | 5 | 5.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCNCC(N)=O)C1 | 10.1016/0960-894X(95)00080-D | |||
19797460 | 127790 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.8 | Clc1cc(Cl)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL356518 | 127790 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.8 | Clc1cc(Cl)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44305467 | 109589 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 430 | 5 | 1 | 2 | 5.8 | CN(C(=O)c1ccccc1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL305375 | 109589 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 430 | 5 | 1 | 2 | 5.8 | CN(C(=O)c1ccccc1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
71720664 | 94213 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 5 | 1 | 2 | 5.2 | FC(F)(F)c1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333638 | 94213 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 5 | 1 | 2 | 5.2 | FC(F)(F)c1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
24784193 | 128872 | 0 | None | - | 0 | Mongolian jird | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 441 | 6 | 2 | 3 | 5.9 | Oc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596481 | 128872 | 0 | None | - | 0 | Mongolian jird | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 441 | 6 | 2 | 3 | 5.9 | Oc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
44456651 | 102225 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN(C(=O)OC(C)(C)C)[C@H]1CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL257112 | 102225 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@@H]1[C@@H](c2ccccc2)CN(C(=O)OC(C)(C)C)[C@H]1CO)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
73348949 | 97597 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.0 | Ic1ccccc1N[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2013.01.025 | |||
CHEMBL2392023 | 97597 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.0 | Ic1ccccc1N[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2013.01.025 | |||
44335354 | 11706 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 629 | 7 | 2 | 4 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Cl)c(Cl)s1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL104708 | 11706 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 629 | 7 | 2 | 4 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1cc(Cl)c(Cl)s1 | 10.1016/s0960-894x(01)00631-x | |||
71458131 | 86459 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
CHEMBL2115343 | 86459 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
44276882 | 103000 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 550 | 8 | 1 | 3 | 7.3 | O=C(C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)NCc1cccnc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL26086 | 103000 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 550 | 8 | 1 | 3 | 7.3 | O=C(C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)NCc1cccnc1 | 10.1016/0960-894X(95)00220-N | |||
71541687 | 94190 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.3 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333615 | 94190 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.3 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
57395687 | 75398 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.3 | CCNC(=O)N1CC[C@@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917846 | 75398 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.3 | CCNC(=O)N1CC[C@@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
44433790 | 96219 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL237100 | 96219 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
11114226 | 211329 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 537 | 10 | 3 | 4 | 7.0 | CC(C)C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL72895 | 211329 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 537 | 10 | 3 | 4 | 7.0 | CC(C)C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OCc1cc2ccccc2o1)C(=O)N[C@@H](C)c1ccccc1 | 10.1021/jm010825z | |||
10075851 | 66796 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 536 | 9 | 3 | 3 | 5.4 | O=C(Cc1c[nH]cn1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173564 | 66796 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 536 | 9 | 3 | 3 | 5.4 | O=C(Cc1c[nH]cn1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
58993461 | 128870 | 0 | None | - | 0 | Mongolian jird | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596479 | 128870 | 0 | None | - | 0 | Mongolian jird | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
44370449 | 126675 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 760 | 20 | 2 | 6 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(CC(N)=O)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL349113 | 126675 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 760 | 20 | 2 | 6 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCN(CC(N)=O)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
46884470 | 14766 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 580 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[nH]c(=O)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090652 | 14766 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 580 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cc[nH]c(=O)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
19098237 | 43895 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145265 | 43895 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
44319086 | 20484 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 722 | 10 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL1194977 | 20484 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 722 | 10 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL553617 | 20484 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 722 | 10 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCN(C)CC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
25129135 | 179376 | 0 | None | -7 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
CHEMBL448998 | 179376 | 0 | None | -7 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
44334113 | 12038 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 548 | 7 | 1 | 4 | 5.9 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL106440 | 12038 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 548 | 7 | 1 | 4 | 5.9 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
44326281 | 213967 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.1 | CC(N)(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL92524 | 213967 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.1 | CC(N)(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
44459032 | 97662 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 393 | 6 | 1 | 3 | 4.4 | CC(=O)N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23926 | 97662 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 393 | 6 | 1 | 3 | 4.4 | CC(=O)N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
44318413 | 212462 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2cccc(C(F)(F)F)c2)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL82220 | 212462 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2cccc(C(F)(F)F)c2)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
24783424 | 128864 | 0 | None | - | 0 | Mongolian jird | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 493 | 6 | 1 | 2 | 7.2 | FC(F)(F)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596473 | 128864 | 0 | None | - | 0 | Mongolian jird | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 493 | 6 | 1 | 2 | 7.2 | FC(F)(F)c1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
10476776 | 115337 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 412 | 5 | 0 | 4 | 4.5 | COc1ccccc1CN(C)C(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL320231 | 115337 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 412 | 5 | 0 | 4 | 4.5 | COc1ccccc1CN(C)C(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44288758 | 107888 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cnc4ccccc4c3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL295122 | 107888 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cnc4ccccc4c3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
107686 | 10152 | 41 | None | - | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
3522 | 10152 | 41 | None | - | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL131171 | 10152 | 41 | None | - | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
44344231 | 120293 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CCC(NCc3ccnc4ccccc34)CC2[C@H](C)c2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL332111 | 120293 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CCC(NCc3ccnc4ccccc34)CC2[C@H](C)c2ccccc2)c1 | 10.1016/S0960-894X(96)00623-3 | |||
44346159 | 21294 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2[C@H](C)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL120190 | 21294 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2[C@H](C)c2ccccc2)c1 | 10.1021/jm9700171 | |||
44177669 | 68035 | 0 | None | -52 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766205 | 68035 | 0 | None | -52 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44319571 | 113817 | 1 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL315532 | 113817 | 1 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
44415437 | 86752 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 537 | 7 | 1 | 3 | 7.5 | O=C(N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)OCc1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212697 | 86752 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 537 | 7 | 1 | 3 | 7.5 | O=C(N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)OCc1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
19797420 | 43634 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145051 | 43634 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10553958 | 108146 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL297068 | 108146 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
9915428 | 180412 | 3 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 15 | 4 | 4 | 5.1 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1cccc(F)c1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
CHEMBL45340 | 180412 | 3 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 15 | 4 | 4 | 5.1 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1cccc(F)c1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1016/0960-894X(95)00313-I | |||
44287895 | 107984 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 579 | 7 | 1 | 5 | 6.5 | COc1ccccc1[C@H](C)C(=O)N1C[C@@H]2[C@H](C1)[C@@](O)(c1ccccc1OC)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL295845 | 107984 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 579 | 7 | 1 | 5 | 6.5 | COc1ccccc1[C@H](C)C(=O)N1C[C@@H]2[C@H](C1)[C@@](O)(c1ccccc1OC)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
44304123 | 207356 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@@H](C(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL59913 | 207356 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 508 | 11 | 1 | 3 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@@H](C(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
10405990 | 214903 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 356 | 5 | 0 | 2 | 4.9 | COC(=O)C1(Cc2ccccc2)CCc2ccc(Cc3ccccc3)cc21 | 10.1016/S0960-894X(01)80821-0 | |||
CHEMBL98011 | 214903 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 356 | 5 | 0 | 2 | 4.9 | COC(=O)C1(Cc2ccccc2)CCc2ccc(Cc3ccccc3)cc21 | 10.1016/S0960-894X(01)80821-0 | |||
9915428 | 180412 | 3 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 15 | 4 | 4 | 5.1 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1cccc(F)c1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1021/jm950892r | |||
CHEMBL45340 | 180412 | 3 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 15 | 4 | 4 | 5.1 | CC(C)[C@H](OC(=O)N[C@](C)(Cc1cccc(F)c1F)C(=O)NCCCCCCCNC(N)=O)c1ccccc1 | 10.1021/jm950892r | |||
44287409 | 165828 | 1 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.9 | O=C(CC(c1ccccc1)c1ccccc1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40969 | 165828 | 1 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.9 | O=C(CC(c1ccccc1)c1ccccc1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44287368 | 162000 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.5 | CN(C(=O)C(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40262 | 162000 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.5 | CN(C(=O)C(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44287461 | 169473 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 493 | 8 | 0 | 1 | 7.3 | CN(CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL41705 | 169473 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 493 | 8 | 0 | 1 | 7.3 | CN(CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
44357469 | 168534 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 1329 | 41 | 13 | 19 | -1.6 | CSCC[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)Cc1noc([C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCCN=C(N)N)n1 | 10.1021/jm990197+ | |||
CHEMBL413904 | 168534 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 1329 | 41 | 13 | 19 | -1.6 | CSCC[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)Cc1noc([C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCCN=C(N)N)n1 | 10.1021/jm990197+ | |||
10367419 | 11176 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 6.6 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CC2CCCCC2)c1 | 10.1021/jm9700171 | |||
CHEMBL101420 | 11176 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 6.6 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CC2CCCCC2)c1 | 10.1021/jm9700171 | |||
11661655 | 112578 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@@H]1CC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126961 | 112578 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@@H]1CC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
10480944 | 66666 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 496 | 6 | 1 | 3 | 6.2 | C=CCC1(Cc2c[nH]c3ccccc23)OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
CHEMBL173013 | 66666 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 496 | 6 | 1 | 3 | 6.2 | C=CCC1(Cc2c[nH]c3ccccc23)OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
2089 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
3795 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
5311311 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL217406 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
44274341 | 88324 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 473 | 6 | 1 | 3 | 5.8 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccccc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21611 | 88324 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 473 | 6 | 1 | 3 | 5.8 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccccc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
56681830 | 73236 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817830 | 73236 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852124 | 73236 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1 | 10.1016/j.bmc.2011.07.014 | |||
10841047 | 64244 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 583 | 13 | 2 | 7 | 3.7 | COC(=O)CN(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL165727 | 64244 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 583 | 13 | 2 | 7 | 3.7 | COC(=O)CN(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
9918576 | 214116 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1021/jm058225d | |||
CHEMBL93556 | 214116 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1021/jm058225d | |||
CHEMBL2370873 | 216717 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(=O)N1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCSC)C(N)=O | 10.1016/S0960-894X(01)80229-8 | |||||
44322406 | 171913 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 514 | 5 | 1 | 3 | 6.2 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL422773 | 171913 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 514 | 5 | 1 | 3 | 6.2 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(Cl)c(Cl)c1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44322515 | 213495 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 6 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL89818 | 213495 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 6 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(Cc1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
10367419 | 11176 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 6.6 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CC2CCCCC2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL101420 | 11176 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 6.6 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2CC2CCCCC2)c1 | 10.1016/S0960-894X(96)00563-X | |||
10460069 | 173117 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 545 | 6 | 1 | 2 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)N(Cc2ccccc2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL427295 | 173117 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 545 | 6 | 1 | 2 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)N(Cc2ccccc2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
44383815 | 67075 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 7 | 1 | 3 | 5.7 | COc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/S0960-894X(00)80693-9 | |||
CHEMBL174365 | 67075 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 7 | 1 | 3 | 5.7 | COc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/S0960-894X(00)80693-9 | |||
12736776 | 17928 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 5.9 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Oc2ccccc21 | 10.1021/jm00085a015 | |||
53641783 | 17928 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 5.9 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Oc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1178362 | 17928 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 5.9 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Oc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL23360 | 17928 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 5.9 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Oc2ccccc21 | 10.1021/jm00085a015 | |||
44459024 | 17933 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 2 | 0 | 2 | 7.9 | CCn1c2[n+](c3cc4ccccc4cc31)C(C)CC2=C/C=C1\N(C)c2ccc3ccccc3c2C1(C)C | 10.1021/jm00085a015 | |||
CHEMBL1178380 | 17933 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 2 | 0 | 2 | 7.9 | CCn1c2[n+](c3cc4ccccc4cc31)C(C)CC2=C/C=C1\N(C)c2ccc3ccccc3c2C1(C)C | 10.1021/jm00085a015 | |||
CHEMBL24818 | 17933 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 2 | 0 | 2 | 7.9 | CCn1c2[n+](c3cc4ccccc4cc31)C(C)CC2=C/C=C1\N(C)c2ccc3ccccc3c2C1(C)C | 10.1021/jm00085a015 | |||
16755254 | 192953 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 515 | 4 | 1 | 5 | 5.9 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL487259 | 192953 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 515 | 4 | 1 | 5 | 5.9 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2nnnc12 | 10.1016/j.bmc.2008.05.067 | |||
44386230 | 68137 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 735 | 8 | 1 | 4 | 7.2 | COc1c(Br)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1Br | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL176811 | 68137 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 735 | 8 | 1 | 4 | 7.2 | COc1c(Br)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1Br | 10.1016/0960-894X(96)00148-5 | |||
10350528 | 113510 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144210 | 113510 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44322511 | 113877 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 5 | 1 | 3 | 5.0 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL315937 | 113877 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 5 | 1 | 3 | 5.0 | O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1016/s0960-894x(01)00727-2 | |||
44346557 | 120297 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 572 | 9 | 4 | 3 | 5.7 | O=C(Cc1ccccc1)N[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL332139 | 120297 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 572 | 9 | 4 | 3 | 5.7 | O=C(Cc1ccccc1)N[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
15295990 | 138885 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 455 | 4 | 2 | 2 | 4.9 | O=C1NC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL369580 | 138885 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 455 | 4 | 2 | 2 | 4.9 | O=C1NC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
54587143 | 67924 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 4 | 0 | 2 | 5.6 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc[n+]1[O-] | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765494 | 67924 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 4 | 0 | 2 | 5.6 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc[n+]1[O-] | 10.1016/j.bmc.2011.02.031 | |||
11547090 | 95009 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CCN1CCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347856 | 95009 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CCN1CCC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
44306398 | 210327 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 527 | 11 | 2 | 4 | 3.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)CCCc1ccccc1 | 10.1021/jm00039a022 | |||
CHEMBL66592 | 210327 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 527 | 11 | 2 | 4 | 3.4 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)CCCc1ccccc1 | 10.1021/jm00039a022 | |||
10432488 | 11668 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 424 | 4 | 0 | 3 | 5.4 | Cc1cc(C)cc(CN(C)C(=O)c2c(-c3ccccc3C)c3ccccc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
CHEMBL104513 | 11668 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 424 | 4 | 0 | 3 | 5.4 | Cc1cc(C)cc(CN(C)C(=O)c2c(-c3ccccc3C)c3ccccc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
10026002 | 116461 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 435 | 4 | 0 | 4 | 4.7 | CN(Cc1ccccc1Cl)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL322714 | 116461 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 435 | 4 | 0 | 4 | 4.7 | CN(Cc1ccccc1Cl)C(=O)c1c(-c2ccc(F)cc2)c2cccnc2c(=O)n1C | 10.1021/jm00016a014 | |||
44358442 | 36579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 569 | 8 | 0 | 3 | 6.3 | CN(CC(Cc1ccccc1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL138727 | 36579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 569 | 8 | 0 | 3 | 6.3 | CN(CC(Cc1ccccc1)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
107686 | 10152 | 41 | None | -15 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
3522 | 10152 | 41 | None | -15 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL131171 | 10152 | 41 | None | -15 | 2 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
104943 | 62160 | 39 | None | - | 3 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL16192 | 62160 | 39 | None | - | 3 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
2089 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
3795 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
5311311 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
CHEMBL217406 | 9542 | 28 | None | - | 5 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
CHEMBL263185 | 217340 | 5 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O | 10.1021/jm070577s | |||||
44270482 | 18754 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 10 | 1 | 4 | 5.2 | CCOC(=O)C[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL1183073 | 18754 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 10 | 1 | 4 | 5.2 | CCOC(=O)C[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL278455 | 18754 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 10 | 1 | 4 | 5.2 | CCOC(=O)C[N+]12CCC(CC1)[C@H](NCc1ccccc1OC)[C@@H]2C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
12736777 | 17927 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 426 | 5 | 0 | 3 | 6.6 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Sc2ccccc21 | 10.1021/jm00085a015 | |||
54433543 | 17927 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 426 | 5 | 0 | 3 | 6.6 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1178360 | 17927 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 426 | 5 | 0 | 3 | 6.6 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Sc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL23287 | 17927 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 426 | 5 | 0 | 3 | 6.6 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)Sc2ccccc21 | 10.1021/jm00085a015 | |||
44348666 | 120269 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 453 | 1 | 1 | 4 | 5.6 | C#CC[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL331978 | 120269 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 453 | 1 | 1 | 4 | 5.6 | C#CC[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
44348801 | 120245 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 489 | 0 | 1 | 4 | 6.4 | C#C[C@]1(O)CCC2C3CC[C@H]4Cc5nc6nc7cc8ccccc8cc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL331934 | 120245 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 489 | 0 | 1 | 4 | 6.4 | C#C[C@]1(O)CCC2C3CC[C@H]4Cc5nc6nc7cc8ccccc8cc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
44337421 | 115305 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL320029 | 115305 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1Cl | 10.1021/jm970499g | |||
44287388 | 162786 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 479 | 7 | 0 | 1 | 6.9 | CN(CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40620 | 162786 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 479 | 7 | 0 | 1 | 6.9 | CN(CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
44297492 | 200471 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 576 | 10 | 1 | 6 | 3.8 | CN(C)c1ccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)cc1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL52717 | 200471 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 576 | 10 | 1 | 6 | 3.8 | CN(C)c1ccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)cc1 | 10.1016/s0960-894x(98)00320-5 | |||
131871 | 126306 | 6 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 450 | 6 | 1 | 2 | 6.1 | FC(F)(F)c1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL345711 | 126306 | 6 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 450 | 6 | 1 | 2 | 6.1 | FC(F)(F)c1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44306416 | 107358 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 9 | 3 | 3 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)CNC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL291634 | 107358 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 9 | 3 | 3 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)CNC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44370769 | 56791 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 507 | 12 | 1 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL156933 | 56791 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 507 | 12 | 1 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)O)C1 | 10.1016/0960-894X(95)00080-D | |||
19797413 | 43632 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 419 | 6 | 0 | 2 | 5.8 | Fc1cc(F)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145050 | 43632 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 419 | 6 | 0 | 2 | 5.8 | Fc1cc(F)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10552574 | 126757 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 10 | 2 | 4 | 3.7 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCCCC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL349882 | 126757 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 10 | 2 | 4 | 3.7 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCCCC1)C(C)=O | 10.1021/jm950616c | |||
44359259 | 31892 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1Cl)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL134737 | 31892 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1Cl)c1ccccc1 | 10.1021/jm00022a010 | |||
44275987 | 106120 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL282331 | 106120 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
9892852 | 91155 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL22194 | 91155 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
44297939 | 108453 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 510 | 9 | 1 | 3 | 6.4 | Cc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL299312 | 108453 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 510 | 9 | 1 | 3 | 6.4 | Cc1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
71699788 | 131559 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 545 | 5 | 0 | 4 | 4.7 | COc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)CC2c2ccc(Cl)c(Cl)c2)cc1 | nan | |||
CHEMBL3642158 | 131559 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 545 | 5 | 0 | 4 | 4.7 | COc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)CC2c2ccc(Cl)c(Cl)c2)cc1 | nan | |||
44289256 | 107307 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 449 | 7 | 1 | 3 | 5.2 | O=C(Cc1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL291298 | 107307 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 449 | 7 | 1 | 3 | 5.2 | O=C(Cc1ccccc1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
44270549 | 17911 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 503 | 9 | 1 | 2 | 6.8 | COc1ccccc1CN[C@H]1C2CC[N+](Cc3ccccc3)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL1178214 | 17911 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 503 | 9 | 1 | 2 | 6.8 | COc1ccccc1CN[C@H]1C2CC[N+](Cc3ccccc3)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
CHEMBL15970 | 17911 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 503 | 9 | 1 | 2 | 6.8 | COc1ccccc1CN[C@H]1C2CC[N+](Cc3ccccc3)(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80246-8 | |||
44312145 | 211495 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 7 | 3 | 2 | 5.1 | O=C(NCCc1ccccc1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL74176 | 211495 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 7 | 3 | 2 | 5.1 | O=C(NCCc1ccccc1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
10793140 | 64189 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 568 | 10 | 1 | 5 | 5.0 | COc1ccccc1CN(CC(NC(=O)CN1CCN(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL165308 | 64189 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 568 | 10 | 1 | 5 | 5.0 | COc1ccccc1CN(CC(NC(=O)CN1CCN(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)C(C)=O | 10.1021/jm950616c | |||
44297604 | 108413 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3Cl)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL299016 | 108413 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 635 | 9 | 1 | 5 | 5.7 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3Cl)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44276732 | 106781 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 7.1 | O=C(NCc1cccnc1)NC[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL286747 | 106781 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 7.1 | O=C(NCc1cccnc1)NC[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
24801102 | 94222 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 350 | 5 | 1 | 3 | 4.2 | Clc1cc(COCC2(c3ccccc3)CCNCC2)cc(Cl)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333647 | 94222 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 350 | 5 | 1 | 3 | 4.2 | Clc1cc(COCC2(c3ccccc3)CCNCC2)cc(Cl)n1 | 10.1016/j.bmcl.2012.11.094 | |||
46884468 | 14764 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 578 | 5 | 0 | 3 | 7.5 | Cc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090650 | 14764 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 578 | 5 | 0 | 3 | 7.5 | Cc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
44289441 | 107885 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 12 | 2 | 4 | 4.9 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)c1ccccc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL295107 | 107885 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 12 | 2 | 4 | 4.9 | COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)c1ccccc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
10453364 | 12172 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 396 | 4 | 0 | 3 | 4.8 | Cc1ccccc1-c1c(C(=O)N(C)Cc2ccccc2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
CHEMBL107145 | 12172 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 396 | 4 | 0 | 3 | 4.8 | Cc1ccccc1-c1c(C(=O)N(C)Cc2ccccc2)n(C)c(=O)c2ccccc12 | 10.1021/jm00016a014 | |||
10433381 | 12356 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 6 | 0 | 4 | 5.2 | CCN(Cc1ccccc1OC)C(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL107689 | 12356 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 6 | 0 | 4 | 5.2 | CCN(Cc1ccccc1OC)C(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
10350528 | 113510 | 0 | None | 251 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144210 | 113510 | 0 | None | 251 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 831 | 18 | 4 | 9 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)OCCCCCCN)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44305511 | 209745 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 566 | 5 | 1 | 2 | 7.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL63014 | 209745 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 566 | 5 | 1 | 2 | 7.9 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)NC2CCCCC2)ccc1-c1ccc(F)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
9823811 | 66689 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 5.5 | COc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
CHEMBL173110 | 66689 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 5.5 | COc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
44358814 | 37866 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(Cl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL139977 | 37866 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 5.9 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(Cl)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
44352062 | 25706 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CC[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL128586 | 25706 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CC[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
131954513 | 168857 | 38 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 357 | 2 | 0 | 4 | 4.3 | COc1ccc(-c2c(C)nn3c(C(F)(F)F)cc(C)nc23)c(F)c1F | 10.1021/acsmedchemlett.7b00317 | |||
CHEMBL4160748 | 168857 | 38 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 357 | 2 | 0 | 4 | 4.3 | COc1ccc(-c2c(C)nn3c(C(F)(F)F)cc(C)nc23)c(F)c1F | 10.1021/acsmedchemlett.7b00317 | |||
21121353 | 108250 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | |||
CHEMBL297776 | 108250 | 0 | None | - | 3 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | |||
54587142 | 67923 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 4 | 1 | 2 | 5.3 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc[n+]1[O-] | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765493 | 67923 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 4 | 1 | 2 | 5.3 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc[n+]1[O-] | 10.1016/j.bmc.2011.02.031 | |||
44321519 | 213507 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
CHEMBL89897 | 213507 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00092a009 | |||
44321519 | 213507 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL89897 | 213507 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
44307089 | 209792 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 445 | 4 | 0 | 2 | 6.0 | CC(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL63278 | 209792 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 445 | 4 | 0 | 2 | 6.0 | CC(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL2112244 | 216010 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cn2ccc3ccccc32)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
76318226 | 112575 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 501 | 6 | 0 | 3 | 6.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCOCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126958 | 112575 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 501 | 6 | 0 | 3 | 6.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCOCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
44294338 | 18821 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCO)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54307293 | 18821 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCO)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183499 | 18821 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCO)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL300854 | 18821 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 4.6 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCO)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
11568372 | 212804 | 5 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL85047 | 212804 | 5 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.7 | FC(F)(F)c1cc(CO[C@@H]2CCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
44380745 | 127076 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL352697 | 127076 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
10245452 | 107965 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 320 | 4 | 1 | 2 | 3.1 | O=C1C(Cc2c[nH]c3ccccc23)OCCN1Cc1ccccc1 | 10.1016/0960-894X(95)00582-E | |||
CHEMBL295680 | 107965 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 320 | 4 | 1 | 2 | 3.1 | O=C1C(Cc2c[nH]c3ccccc23)OCCN1Cc1ccccc1 | 10.1016/0960-894X(95)00582-E | |||
9888665 | 128759 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL359206 | 128759 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 7 | 0 | 2 | 6.3 | Cc1cc(C)cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
10506928 | 126996 | 0 | None | 39 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL352102 | 126996 | 0 | None | 39 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
44297498 | 108779 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3Cl)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL301630 | 108779 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccccc3Cl)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10552836 | 10959 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 7.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL100141 | 10959 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 7.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
58993657 | 128845 | 0 | None | - | 0 | Mongolian jird | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.7 | Cn1nnc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596454 | 128845 | 0 | None | - | 0 | Mongolian jird | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.7 | Cn1nnc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2015.04.098 | |||
16755228 | 180483 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 526 | 4 | 0 | 2 | 8.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cccc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL453581 | 180483 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 526 | 4 | 0 | 2 | 8.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cccc12 | 10.1016/j.bmc.2008.05.067 | |||
19797456 | 41243 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(C)c(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL142855 | 41243 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(C)c(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44319249 | 212851 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 4.4 | COc1ccc(C2(CCN3CCC(C(N)=O)(c4ccccc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL85499 | 212851 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 4.4 | COc1ccc(C2(CCN3CCC(C(N)=O)(c4ccccc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10013-0 | |||
44304176 | 209598 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL62357 | 209598 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15154442 | 20938 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 5 | 0 | 2 | 6.8 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00085a015 | |||
53703341 | 20938 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 5 | 0 | 2 | 6.8 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1198573 | 20938 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 5 | 0 | 2 | 6.8 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL23147 | 20938 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 5 | 0 | 2 | 6.8 | CCN1/C(=C\C=C\c2n(CC)c3cc4ccccc4cc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00085a015 | |||
10071902 | 116179 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 439 | 5 | 1 | 3 | 5.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)CCc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL321979 | 116179 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 439 | 5 | 1 | 3 | 5.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)CCc3ccccc3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL2369630 | 216424 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
44346480 | 121640 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | N[C@H](COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL334189 | 121640 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | N[C@H](COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL2369767 | 216463 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | C/C=C/CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
44299298 | 203028 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | NC(COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56176 | 203028 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | NC(COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
15037918 | 51628 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 5.2 | Fc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL152239 | 51628 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 5.2 | Fc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
19797436 | 43611 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 461 | 6 | 0 | 2 | 6.3 | Brc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL145030 | 43611 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 461 | 6 | 0 | 2 | 6.3 | Brc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
19797448 | 44016 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL145360 | 44016 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44358500 | 38286 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 539 | 9 | 0 | 8 | 4.2 | COc1cc(C(=O)N(C)CC(c2cccc3c2OCO3)N2CCC(N3CCCCC3)CC2)cc(OC)c1OC | 10.1021/jm000986n | |||
CHEMBL140360 | 38286 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 539 | 9 | 0 | 8 | 4.2 | COc1cc(C(=O)N(C)CC(c2cccc3c2OCO3)N2CCC(N3CCCCC3)CC2)cc(OC)c1OC | 10.1021/jm000986n | |||
44287861 | 168518 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 5 | 1 | 4 | 4.4 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)[C@@H](O)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL41375 | 168518 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 5 | 1 | 4 | 4.4 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)[C@@H](O)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
19797446 | 41319 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL142919 | 41319 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
10793492 | 118079 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 587 | 10 | 4 | 3 | 4.7 | O=C(NCCc1c[nH]c2ccccc12)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL326649 | 118079 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 587 | 10 | 4 | 3 | 4.7 | O=C(NCCc1c[nH]c2ccccc12)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
44358426 | 37658 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 595 | 6 | 0 | 3 | 7.3 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1C(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139753 | 37658 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 595 | 6 | 0 | 3 | 7.3 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCCCC1C(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
10336036 | 119123 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 318 | 4 | 1 | 1 | 3.8 | O=C(Cc1c[nH]c2ccccc12)N1CCC(Cc2ccccc2)C1 | 10.1016/S0960-894X(96)00570-7 | |||
CHEMBL32940 | 119123 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 318 | 4 | 1 | 1 | 3.8 | O=C(Cc1c[nH]c2ccccc12)N1CCC(Cc2ccccc2)C1 | 10.1016/S0960-894X(96)00570-7 | |||
44359055 | 39106 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 584 | 10 | 4 | 5 | 6.3 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL141050 | 39106 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 584 | 10 | 4 | 5 | 6.3 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 | 10.1021/jm00022a010 | |||
10501444 | 108654 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL300722 | 108654 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
44287555 | 165579 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40944 | 165579 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
23294214 | 175939 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 7 | 1 | 4 | 6.9 | O=C(c1ccccc1)N1CCCC(CCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL440465 | 175939 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 7 | 1 | 4 | 6.9 | O=C(c1ccccc1)N1CCCC(CCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(98)00215-7 | |||
76332769 | 112584 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 8 | 0 | 2 | 7.5 | CCN(CC)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126967 | 112584 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 8 | 0 | 2 | 7.5 | CCN(CC)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
10646925 | 37756 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 407 | 5 | 1 | 2 | 4.1 | Ic1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL139868 | 37756 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 407 | 5 | 1 | 2 | 4.1 | Ic1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
44287895 | 107984 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 579 | 7 | 1 | 5 | 6.5 | COc1ccccc1[C@H](C)C(=O)N1C[C@@H]2[C@H](C1)[C@@](O)(c1ccccc1OC)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL295845 | 107984 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 579 | 7 | 1 | 5 | 6.5 | COc1ccccc1[C@H](C)C(=O)N1C[C@@H]2[C@H](C1)[C@@](O)(c1ccccc1OC)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
16755230 | 179754 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 527 | 4 | 0 | 3 | 7.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2ccnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL451773 | 179754 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 527 | 4 | 0 | 3 | 7.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2ccnc12 | 10.1016/j.bmc.2008.05.067 | |||
24801459 | 94206 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 5 | 0 | 4 | 4.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C#N)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333631 | 94206 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 5 | 0 | 4 | 4.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C#N)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
15755301 | 107847 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 630 | 15 | 4 | 7 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL294814 | 107847 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 630 | 15 | 4 | 7 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
44345010 | 21252 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2/CC[C@H](NC(=O)c3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL120126 | 21252 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2/CC[C@H](NC(=O)c3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
10041813 | 103729 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 322 | 7 | 2 | 3 | 3.4 | CCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL26623 | 103729 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 322 | 7 | 2 | 3 | 3.4 | CCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00035a006 | |||
10041813 | 103729 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 322 | 7 | 2 | 3 | 3.4 | CCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00066a015 | |||
CHEMBL26623 | 103729 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 322 | 7 | 2 | 3 | 3.4 | CCN[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00066a015 | |||
44297822 | 201803 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 603 | 12 | 2 | 5 | 4.8 | CS(=O)(=O)NCC1(c2ccccc2)CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL54931 | 201803 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 603 | 12 | 2 | 5 | 4.8 | CS(=O)(=O)NCC1(c2ccccc2)CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
44321099 | 213004 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 426 | 7 | 0 | 3 | 5.4 | COc1ccccc1CN(C)[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL86659 | 213004 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 426 | 7 | 0 | 3 | 5.4 | COc1ccccc1CN(C)[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
15755334 | 103337 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 578 | 13 | 6 | 6 | 1.6 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a011 | |||
CHEMBL263013 | 103337 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 578 | 13 | 6 | 6 | 1.6 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a011 | |||
44177670 | 68036 | 0 | None | -190 | 4 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766206 | 68036 | 0 | None | -190 | 4 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
71541471 | 94211 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 436 | 6 | 0 | 3 | 5.8 | CC(C)=Cc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333636 | 94211 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 436 | 6 | 0 | 3 | 5.8 | CC(C)=Cc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
71452815 | 86487 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL2115528 | 86487 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
44328405 | 112975 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 6 | 1 | 2 | 6.4 | Clc1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL313863 | 112975 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 6 | 1 | 2 | 6.4 | Clc1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
44338646 | 15927 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 6.0 | CC(C)c1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL110086 | 15927 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 474 | 7 | 1 | 3 | 6.0 | CC(C)c1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
10552836 | 10959 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 7.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL100141 | 10959 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 7.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3ccco3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
10576866 | 118268 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 6 | 1 | 5 | 5.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nn[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL327736 | 118268 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 6 | 1 | 5 | 5.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nn[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44294398 | 18015 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 0 | 4 | 5.6 | CCN1/C(=C/C=C/c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00109a034 | |||
54220048 | 18015 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 0 | 4 | 5.6 | CCN1/C(=C/C=C/c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00109a034 | |||
CHEMBL1178902 | 18015 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 0 | 4 | 5.6 | CCN1/C(=C/C=C/c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00109a034 | |||
CHEMBL48734 | 18015 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 0 | 4 | 5.6 | CCN1/C(=C/C=C/c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc21 | 10.1021/jm00109a034 | |||
16755206 | 193418 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 512 | 4 | 1 | 2 | 7.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cccc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL488045 | 193418 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 512 | 4 | 1 | 2 | 7.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cccc12 | 10.1016/j.bmc.2008.05.067 | |||
44303938 | 209927 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 713 | 16 | 5 | 10 | 3.0 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL64166 | 209927 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 713 | 16 | 5 | 10 | 3.0 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15154438 | 17932 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 422 | 4 | 0 | 2 | 6.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
53968534 | 17932 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 422 | 4 | 0 | 2 | 6.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL1178371 | 17932 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 422 | 4 | 0 | 2 | 6.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL23682 | 17932 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 422 | 4 | 0 | 2 | 6.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
44288936 | 164947 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 6 | 0 | 3 | 6.9 | CN(Cc1ccnc2ccccc12)[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL40875 | 164947 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 6 | 0 | 3 | 6.9 | CN(Cc1ccnc2ccccc12)[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
11409185 | 106199 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
CHEMBL282853 | 106199 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 488 | 4 | 1 | 2 | 7.2 | Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm034219a | |||
44287390 | 162552 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.3 | O=C(NCC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40587 | 162552 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.3 | O=C(NCC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
44338557 | 16120 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 330 | 6 | 1 | 3 | 3.5 | Clc1cccc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL111244 | 16120 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 330 | 6 | 1 | 3 | 3.5 | Clc1cccc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00563-2 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
11757401 | 66720 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL173231 | 66720 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 555 | 9 | 2 | 4 | 4.8 | O=C(CN1CCOCC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
56671913 | 73242 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 5.3 | COc1ccc(F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817888 | 73242 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 5.3 | COc1ccc(F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852140 | 73242 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 5.3 | COc1ccc(F)cc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
46884473 | 14561 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.6 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cncnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089397 | 14561 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.6 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cncnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
10817203 | 64304 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 12 | 2 | 6 | 3.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)S(C)(=O)=O | 10.1021/jm950616c | |||
CHEMBL166240 | 64304 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 12 | 2 | 6 | 3.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)S(C)(=O)=O | 10.1021/jm950616c | |||
44305271 | 109021 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 528 | 4 | 0 | 2 | 7.0 | CN(C)C(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL303119 | 109021 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 528 | 4 | 0 | 2 | 7.0 | CN(C)C(=O)c1ccc(-c2ccc(Cl)cc2)c(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00382-7 | |||
44319323 | 20519 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL1195230 | 20519 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL554092 | 20519 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL394671 | 219257 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
CHEMBL394671 | 219257 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(N)=O | 10.1021/jm070577s | |||||
44433788 | 95308 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 5 | 1 | 3 | 4.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)C2CCNCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL235220 | 95308 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 5 | 1 | 3 | 4.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(C(=O)C2CCNCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
44328425 | 176250 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 6.0 | COc1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL442962 | 176250 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 6.0 | COc1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
44233184 | 201547 | 0 | None | 12 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL538131 | 201547 | 0 | None | 12 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
44410162 | 83904 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 443 | 4 | 1 | 2 | 6.6 | C[C@@H](OC1CCC2CCC1(c1ccccc1)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL207698 | 83904 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 443 | 4 | 1 | 2 | 6.6 | C[C@@H](OC1CCC2CCC1(c1ccccc1)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
44294261 | 86408 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 593 | 7 | 0 | 2 | 9.1 | Fc1ccc(C2CCN([C@H]3CC[C@](COCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115010 | 86408 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 593 | 7 | 0 | 2 | 9.1 | Fc1ccc(C2CCN([C@H]3CC[C@](COCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
10086982 | 122970 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 314 | 6 | 3 | 4 | 2.0 | O=C(N[C@@H](Cc1ccccc1)C(=O)NO)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL3358422 | 122970 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 314 | 6 | 3 | 4 | 2.0 | O=C(N[C@@H](Cc1ccccc1)C(=O)NO)OCc1ccccc1 | 10.1021/ml5002954 | |||
10072926 | 116463 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 459 | 4 | 1 | 3 | 6.1 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3ccccc3Cl)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL322718 | 116463 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 459 | 4 | 1 | 3 | 6.1 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3ccccc3Cl)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm990220r | |||
134138503 | 161219 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 694 | 13 | 6 | 7 | 2.8 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acsmedchemlett.6b00381 | |||
CHEMBL3932836 | 161219 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 694 | 13 | 6 | 7 | 2.8 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acsmedchemlett.6b00381 | |||
CHEMBL3990081 | 161219 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 694 | 13 | 6 | 7 | 2.8 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acsmedchemlett.6b00381 | |||
49863734 | 22105 | 0 | None | 13 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
CHEMBL1214027 | 22105 | 0 | None | 13 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
44326362 | 214076 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.5 | CC(OCC(N)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL93243 | 214076 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.5 | CC(OCC(N)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00476-A | |||
16755231 | 195771 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 527 | 4 | 0 | 3 | 7.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cncc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL508659 | 195771 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 527 | 4 | 0 | 3 | 7.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cncc12 | 10.1016/j.bmc.2008.05.067 | |||
44306219 | 109506 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL304901 | 109506 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44358703 | 122842 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 625 | 7 | 0 | 4 | 7.3 | COc1ccccc1C(C1CCCCN1C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL335624 | 122842 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 625 | 7 | 0 | 4 | 7.3 | COc1ccccc1C(C1CCCCN1C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
9853506 | 19861 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 709 | 10 | 0 | 7 | 6.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL1190281 | 19861 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 709 | 10 | 0 | 7 | 6.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL540553 | 19861 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 709 | 10 | 0 | 7 | 6.1 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(=O)N4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
9799676 | 202598 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COCC(C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL55823 | 202598 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COCC(C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
44456748 | 175959 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@@H]1[C@H](CO)N(C(=O)OC(C)(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL440587 | 175959 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 6.7 | C[C@@H](O[C@@H]1[C@H](CO)N(C(=O)OC(C)(C)C)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
10071073 | 12123 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 425 | 4 | 0 | 4 | 4.8 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C)cc(C)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
CHEMBL106904 | 12123 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 425 | 4 | 0 | 4 | 4.8 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C)cc(C)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
44233410 | 202373 | 0 | None | 38 | 3 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1327 | 28 | 14 | 16 | 1.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL555504 | 202373 | 0 | None | 38 | 3 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1327 | 28 | 14 | 16 | 1.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
44433789 | 152912 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL391963 | 152912 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 583 | 5 | 0 | 3 | 5.2 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
10792813 | 64290 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 552 | 11 | 2 | 4 | 5.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL166144 | 64290 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 552 | 11 | 2 | 4 | 5.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
44319224 | 113853 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 722 | 10 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCN(C)CC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL315814 | 113853 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 722 | 10 | 0 | 7 | 6.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCN(C)CC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
10360490 | 95514 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.8 | Clc1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL23617 | 95514 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.8 | Clc1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL238168 | 217170 | 7 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(N)=O | 10.1021/jm070577s | |||||
10007035 | 86300 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 524 | 8 | 3 | 4 | 3.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL2114031 | 86300 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 524 | 8 | 3 | 4 | 3.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
10460415 | 123317 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 559 | 7 | 1 | 3 | 6.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc(F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL336261 | 123317 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 559 | 7 | 1 | 3 | 6.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cccc(F)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
10745307 | 172185 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1cccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)c1 | 10.1021/jm950616c | |||
CHEMBL423824 | 172185 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 553 | 11 | 2 | 5 | 4.1 | COc1cccc(CN(CC(Cc2c[nH]c3ccccc23)NC(=O)CN2CCN(c3ccccc3)CC2)C(C)=O)c1 | 10.1021/jm950616c | |||
CHEMBL238168 | 217170 | 7 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(N)=O | 10.1021/jm070577s | |||||
11547594 | 112593 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126975 | 112593 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
136043853 | 145693 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 5.8 | CN(Cc1n[nH]c(O)n1)C[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL378340 | 145693 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 5.8 | CN(Cc1n[nH]c(O)n1)C[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
58993634 | 128878 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 522 | 6 | 1 | 3 | 6.6 | N#Cc1c(F)c(F)c(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c(F)c1F | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596487 | 128878 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 522 | 6 | 1 | 3 | 6.6 | N#Cc1c(F)c(F)c(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c(F)c1F | 10.1016/j.bmcl.2015.04.098 | |||
10438407 | 107430 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 2 | 6 | 4.4 | CS(=O)(=O)Nc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL292190 | 107430 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 2 | 6 | 4.4 | CS(=O)(=O)Nc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
57395686 | 78392 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 408 | 7 | 1 | 4 | 4.6 | CCN1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1917841 | 78392 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 408 | 7 | 1 | 4 | 4.6 | CCN1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963411 | 78392 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 408 | 7 | 1 | 4 | 4.6 | CCN1CC[C@H](NCc2cc(OC(F)(F)F)ccc2OC)[C@H](c2ccccc2)C1 | 10.1016/j.bmc.2011.08.070 | |||
53249015 | 67932 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | Cc1nc(N2CCN(C)CC2)cc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765500 | 67932 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | Cc1nc(N2CCN(C)CC2)cc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
9939040 | 11782 | 7 | None | 2 | 4 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL105060 | 11782 | 7 | None | 2 | 4 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00631-x | |||
44358864 | 37119 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1ccc2c(c1)OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL139176 | 37119 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 599 | 7 | 0 | 5 | 6.1 | CN(CC(c1ccc2c(c1)OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
44319306 | 113874 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccncc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL315923 | 113874 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccncc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44274183 | 89239 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cc(Cl)ccc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21760 | 89239 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cc(Cl)ccc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
56661423 | 73228 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2C(F)(F)F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817832 | 73228 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2C(F)(F)F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852069 | 73228 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2C(F)(F)F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
136043849 | 145478 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 542 | 9 | 2 | 5 | 6.1 | CN(CC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1)Cc1n[nH]c(O)n1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL377916 | 145478 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 542 | 9 | 2 | 5 | 6.1 | CN(CC[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1)Cc1n[nH]c(O)n1 | 10.1016/j.bmcl.2006.06.035 | |||
44306108 | 109613 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 606 | 8 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL305548 | 109613 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 606 | 8 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
22293578 | 193906 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 591 | 7 | 0 | 1 | 9.9 | Fc1ccc(C2CCN(C3CCC(CCCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL49175 | 193906 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 591 | 7 | 0 | 1 | 9.9 | Fc1ccc(C2CCN(C3CCC(CCCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
44415424 | 148233 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 537 | 7 | 1 | 3 | 7.5 | O=C(N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1)OCc1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL384244 | 148233 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 537 | 7 | 1 | 3 | 7.5 | O=C(N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1)OCc1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
11498370 | 107953 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 654 | 8 | 1 | 7 | 5.7 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[C@@H]4O)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
CHEMBL295615 | 107953 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 654 | 8 | 1 | 7 | 5.7 | COc1cc(C(=O)N2CCO[C@](CCN3CCC4(CC3)c3ccccc3C[C@@H]4O)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(00)00324-3 | |||
15295987 | 138130 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 4 | 2 | 2 | 4.3 | O=C1NC(Cc2c[nH]c3ccccc23)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
CHEMBL368804 | 138130 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 4 | 2 | 2 | 4.3 | O=C1NC(Cc2c[nH]c3ccccc23)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm00006a011 | |||
CHEMBL5283681 | 201003 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCO[C@]23CC[C@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1021/acs.jmedchem.1c00790 | |||
15755316 | 209672 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 703 | 16 | 4 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCC1CCCCC1 | 10.1021/jm00089a011 | |||
CHEMBL62711 | 209672 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 703 | 16 | 4 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCC1CCCCC1 | 10.1021/jm00089a011 | |||
44299298 | 203028 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | NC(COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
CHEMBL56176 | 203028 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 317 | 7 | 1 | 2 | 4.4 | NC(COCc1ccccc1)C(c1ccccc1)c1ccccc1 | 10.1021/jm0311487 | |||
16755256 | 179878 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 529 | 4 | 1 | 5 | 6.2 | Cc1ccc(-c2c(C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3nnnn3c3ccccc23)cc1 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL452027 | 179878 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 529 | 4 | 1 | 5 | 6.2 | Cc1ccc(-c2c(C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3nnnn3c3ccccc23)cc1 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL2369599 | 216412 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm960281e | |||||
14986135 | 170180 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL419500 | 170180 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
44287606 | 107287 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 5 | 0 | 4 | 4.6 | CN(C)c1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL291146 | 107287 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 5 | 0 | 4 | 4.6 | CN(C)c1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
10228092 | 84080 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cnccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL20826 | 84080 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 6 | 1 | 4 | 5.4 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cnccc21 | 10.1016/s0960-894x(01)00182-2 | |||
58993510 | 128832 | 0 | None | - | 0 | Mongolian jird | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccn2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596200 | 128832 | 0 | None | - | 0 | Mongolian jird | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 426 | 6 | 1 | 3 | 5.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccn2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
54580277 | 67934 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 466 | 4 | 0 | 2 | 6.7 | Cc1cc(-c2ccccc2)c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)n1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765502 | 67934 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 466 | 4 | 0 | 2 | 6.7 | Cc1cc(-c2ccccc2)c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)n1 | 10.1016/j.bmc.2011.02.031 | |||
9830535 | 213595 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 17 | 1 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL90416 | 213595 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 17 | 1 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
9830535 | 213595 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 17 | 1 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL90416 | 213595 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 17 | 1 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
44294324 | 19134 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 7 | 0 | 6 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCOC(C)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54414362 | 19134 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 7 | 0 | 6 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCOC(C)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1185473 | 19134 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 7 | 0 | 6 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCOC(C)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL416468 | 19134 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 7 | 0 | 6 | 5.2 | CCn1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)[n+](CCCOC(C)=O)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
71583095 | 94994 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347693 | 94994 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.0 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCCNC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
71699791 | 131562 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 591 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(-c4ccccc4)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642161 | 131562 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 591 | 5 | 0 | 3 | 6.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(-c4ccccc4)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
44337667 | 115634 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 4.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL321021 | 115634 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 4.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
10744740 | 116440 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 528 | 9 | 2 | 3 | 4.6 | Cc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL322508 | 116440 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 528 | 9 | 2 | 3 | 4.6 | Cc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
15154446 | 17924 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.0 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCOC(C)=O)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
53746881 | 17924 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.0 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCOC(C)=O)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL1178355 | 17924 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.0 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCOC(C)=O)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL23073 | 17924 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.0 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCOC(C)=O)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
10318477 | 174089 | 40 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 394 | 6 | 2 | 4 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL429395 | 174089 | 40 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 394 | 6 | 2 | 4 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00035a006 | |||
10318477 | 174089 | 40 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 394 | 6 | 2 | 4 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00066a015 | |||
CHEMBL429395 | 174089 | 40 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 394 | 6 | 2 | 4 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm00066a015 | |||
107686 | 10152 | 41 | None | 15 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
3522 | 10152 | 41 | None | 15 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL131171 | 10152 | 41 | None | 15 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
19797466 | 41372 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL142961 | 41372 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44297701 | 108468 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@@H](COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL299388 | 108468 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@@H](COCc3ccccc3)NCc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
11489240 | 102065 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL25639 | 102065 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CO)nc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
44274520 | 89358 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 479 | 5 | 0 | 5 | 4.9 | COc1ccccc1N1CCN(C(=O)CCc2c3n(c4ccc(C)cc24)C(=O)c2ccccc2-3)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21788 | 89358 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 479 | 5 | 0 | 5 | 4.9 | COc1ccccc1N1CCN(C(=O)CCc2c3n(c4ccc(C)cc24)C(=O)c2ccccc2-3)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44358861 | 125415 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(F)c(F)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL341681 | 125415 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 491 | 8 | 3 | 3 | 5.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc(F)c(F)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
15755299 | 107665 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 13 | 3 | 8 | 3.7 | CC(C)(C)OC(=O)NCC(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL293726 | 107665 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 13 | 3 | 8 | 3.7 | CC(C)(C)OC(=O)NCC(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
10325464 | 126912 | 0 | None | -25 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL351236 | 126912 | 0 | None | -25 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCC(N2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
44458828 | 17931 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 408 | 3 | 0 | 3 | 5.6 | CCN1/C(=C\C=C2CC[n+]3c2n(CC)c2cc4ccccc4cc23)Oc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL1178368 | 17931 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 408 | 3 | 0 | 3 | 5.6 | CCN1/C(=C\C=C2CC[n+]3c2n(CC)c2cc4ccccc4cc23)Oc2ccccc21 | 10.1021/jm00085a015 | |||
CHEMBL23533 | 17931 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 408 | 3 | 0 | 3 | 5.6 | CCN1/C(=C\C=C2CC[n+]3c2n(CC)c2cc4ccccc4cc23)Oc2ccccc21 | 10.1021/jm00085a015 | |||
44281769 | 116437 | 7 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 484 | 10 | 4 | 4 | 3.2 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/0960-894X(95)00582-E | |||
CHEMBL32248 | 116437 | 7 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 484 | 10 | 4 | 4 | 3.2 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/0960-894X(95)00582-E | |||
19098237 | 43895 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL145265 | 43895 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 533 | 7 | 0 | 2 | 7.7 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(Cc2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
10428330 | 177001 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 356 | 4 | 1 | 3 | 3.5 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(F)cc(F)c1 | 10.1021/jm00006a011 | |||
CHEMBL444552 | 177001 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 356 | 4 | 1 | 3 | 3.5 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc(F)cc(F)c1 | 10.1021/jm00006a011 | |||
44297562 | 201816 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 629 | 9 | 1 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NC(=O)Cc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54940 | 201816 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 629 | 9 | 1 | 5 | 4.6 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NC(=O)Cc3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10576866 | 118268 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 6 | 1 | 5 | 5.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nn[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
CHEMBL327736 | 118268 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 6 | 1 | 5 | 5.2 | FC(F)(F)c1cc(CO[C@H]2CCCN(Cc3nn[nH]n3)[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9506534 | |||
46881600 | 13878 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 493 | 5 | 1 | 3 | 5.3 | CC(=O)N1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)[C@@H]1CO | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1085196 | 13878 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 493 | 5 | 1 | 3 | 5.3 | CC(=O)N1C[C@H](O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)[C@@H]1CO | 10.1016/j.bmcl.2010.01.065 | |||
44302017 | 206110 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 446 | 9 | 4 | 3 | 4.3 | CC(C)COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12 | 10.1016/S0960-894X(97)00346-6 | |||
CHEMBL59060 | 206110 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 446 | 9 | 4 | 3 | 4.3 | CC(C)COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12 | 10.1016/S0960-894X(97)00346-6 | |||
71541370 | 94216 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 432 | 5 | 0 | 3 | 5.6 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333641 | 94216 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 432 | 5 | 0 | 3 | 5.6 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
10404051 | 92822 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 325 | 6 | 1 | 3 | 3.1 | CC(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23077 | 92822 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 325 | 6 | 1 | 3 | 3.1 | CC(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
10027661 | 66473 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 469 | 4 | 2 | 2 | 4.3 | O=C1CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C(Cc2c[nH]c3ccccc23)N1 | 10.1021/jm00006a011 | |||
CHEMBL172308 | 66473 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 469 | 4 | 2 | 2 | 4.3 | O=C1CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C(Cc2c[nH]c3ccccc23)N1 | 10.1021/jm00006a011 | |||
54585203 | 67933 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 452 | 4 | 1 | 2 | 6.3 | Cc1cc(-c2ccccc2)c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)n1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765501 | 67933 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 452 | 4 | 1 | 2 | 6.3 | Cc1cc(-c2ccccc2)c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)n1 | 10.1016/j.bmc.2011.02.031 | |||
10053205 | 123363 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL336589 | 123363 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
46884469 | 14765 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 6 | 0 | 4 | 7.2 | COc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090651 | 14765 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 6 | 0 | 4 | 7.2 | COc1cc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)ccn1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL2369630 | 216424 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
44344195 | 170139 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 5 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2C3CC(NCc4ccnc5ccccc45)CC2C(c2ccccc2)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL419232 | 170139 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 5 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2C3CC(NCc4ccnc5ccccc45)CC2C(c2ccccc2)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL307433 | 217759 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(C)=O)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
44328357 | 118314 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 490 | 6 | 1 | 2 | 7.0 | FC(F)(F)c1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL327943 | 118314 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 490 | 6 | 1 | 2 | 7.0 | FC(F)(F)c1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
44287556 | 106988 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 6 | 0 | 1 | 6.2 | CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL288382 | 106988 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 6 | 0 | 1 | 6.2 | CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
11641636 | 112594 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 6 | 0 | 3 | 6.1 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCOCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126976 | 112594 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 6 | 0 | 3 | 6.1 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCOCC3)C2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
24801457 | 94218 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333643 | 94218 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
44415472 | 146379 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@H]1CC[C@@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL379744 | 146379 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@H]1CC[C@@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44433781 | 96702 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 6.4 | CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL237992 | 96702 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 6.4 | CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@@H](C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 | 10.1016/j.bmcl.2007.08.028 | |||
44303900 | 169683 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 751 | 15 | 3 | 10 | 3.9 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N1C(C(=O)c2ccccc2)CC[C@H]1C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL417390 | 169683 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 751 | 15 | 3 | 10 | 3.9 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N1C(C(=O)c2ccccc2)CC[C@H]1C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
15154449 | 18752 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCO)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
54080603 | 18752 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCO)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL1183064 | 18752 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCO)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
CHEMBL278135 | 18752 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.4 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CCO)c2cc3ccccc3cc21 | 10.1021/jm00085a015 | |||
44297724 | 108700 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 585 | 8 | 1 | 4 | 5.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL301008 | 108700 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 585 | 8 | 1 | 4 | 5.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(CCc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44286772 | 174618 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.2 | O=C(NCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL43085 | 174618 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 1 | 1 | 6.2 | O=C(NCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
56668295 | 73247 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 409 | 5 | 0 | 2 | 5.3 | O=C1CCN(Cc2ccccc2F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817836 | 73247 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 409 | 5 | 0 | 2 | 5.3 | O=C1CCN(Cc2ccccc2F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852171 | 73247 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 409 | 5 | 0 | 2 | 5.3 | O=C1CCN(Cc2ccccc2F)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
10393390 | 105053 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 576 | 8 | 0 | 3 | 7.6 | CC(=O)C1(c2ccccc2)CCN(CCCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)c3ccccc3)C2)CC1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL27463 | 105053 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 576 | 8 | 0 | 3 | 7.6 | CC(=O)C1(c2ccccc2)CCN(CCCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)c3ccccc3)C2)CC1 | 10.1016/s0960-894x(98)00215-7 | |||
10317867 | 11636 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 4.5 | COc1ccccc1CNCc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104345 | 11636 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 4.5 | COc1ccccc1CNCc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44287511 | 151516 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL39089 | 151516 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 5 | 0 | 1 | 6.5 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
24785190 | 128848 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 415 | 6 | 1 | 3 | 5.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccco2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596457 | 128848 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 415 | 6 | 1 | 3 | 5.8 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccco2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
52941506 | 24539 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
CHEMBL1258732 | 24539 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 530 | 4 | 1 | 3 | 5.7 | C[C@@H](O[C@H]1CN2C(=O)[C@@H]3C[C@H](N)C[C@@H]3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.07.058 | |||
76314659 | 112589 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 501 | 8 | 0 | 2 | 7.9 | CC(C)N(C(C)C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126971 | 112589 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 501 | 8 | 0 | 2 | 7.9 | CC(C)N(C(C)C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
44287819 | 108173 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 486 | 5 | 0 | 4 | 3.6 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)C(=O)C[S+]([O-])C2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL297244 | 108173 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 486 | 5 | 0 | 4 | 3.6 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)C(=O)C[S+]([O-])C2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
10386984 | 12185 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 4.5 | COc1ccccc1CNC(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL107220 | 12185 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 4.5 | COc1ccccc1CNC(=O)c1c(-c2ccccc2C)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
10625208 | 62635 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 500 | 10 | 1 | 5 | 3.7 | COc1ccccc1CN(CC(NC(=O)CN1CCN(c2ccccc2)CC1)c1ccccc1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL162332 | 62635 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 500 | 10 | 1 | 5 | 3.7 | COc1ccccc1CN(CC(NC(=O)CN1CCN(c2ccccc2)CC1)c1ccccc1)C(C)=O | 10.1021/jm950616c | |||
76332768 | 112583 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126966 | 112583 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 459 | 6 | 0 | 2 | 6.7 | CN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2014.01.036 | |||
44288896 | 175766 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1)c1ccnc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43912 | 175766 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1)c1ccnc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL2372519 | 217047 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C1CCc2cc3ccccc3cc21)C(N)=O | 10.1021/jm00037a009 | |||||
44277452 | 107859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(C)c(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL29487 | 107859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 6 | 0 | 2 | 6.1 | Cc1ccc(C)c(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80349-2 | |||
44348667 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL124542 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL333069 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
44212283 | 66633 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 593 | 9 | 1 | 4 | 5.6 | COc1ccccc1CC(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL172915 | 66633 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 593 | 9 | 1 | 4 | 5.6 | COc1ccccc1CC(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
71541371 | 94221 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 374 | 5 | 0 | 3 | 4.0 | CN1CCC(COCc2cncc(Br)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333646 | 94221 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 374 | 5 | 0 | 3 | 4.0 | CN1CCC(COCc2cncc(Br)c2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
10253192 | 11695 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 449 | 4 | 1 | 3 | 5.7 | CN(Cc1ccccc1Cl)C(=O)Nc1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104654 | 11695 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 449 | 4 | 1 | 3 | 5.7 | CN(Cc1ccccc1Cl)C(=O)Nc1c(-c2ccc(F)cc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44312028 | 109629 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 9 | 1 | 5 | 5.1 | CSN1CC2(CCN(C(=O)N[C@@H](COCc3ccccc3)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL305609 | 109629 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 9 | 1 | 5 | 5.1 | CSN1CC2(CCN(C(=O)N[C@@H](COCc3ccccc3)C(=O)N(C)Cc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00395-3 | |||
10627355 | 126788 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
CHEMBL350151 | 126788 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 596 | 13 | 2 | 6 | 3.6 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CN(C)C | 10.1021/jm950616c | |||
44328395 | 114289 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 490 | 6 | 1 | 2 | 6.7 | FC(F)(F)c1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL318629 | 114289 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 490 | 6 | 1 | 2 | 6.7 | FC(F)(F)c1ccccc1CNC1C2C3CCCC2CN(C3)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
19003169 | 109565 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 269 | 6 | 1 | 2 | 3.4 | Cc1cc(C)cc(COCC(N)Cc2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL305274 | 109565 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 269 | 6 | 1 | 2 | 3.4 | Cc1cc(C)cc(COCC(N)Cc2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
44321047 | 212960 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1Cc1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL86378 | 212960 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 336 | 6 | 1 | 3 | 3.5 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1Cc1ccccc1 | 10.1021/jm00092a009 | |||
44326328 | 213884 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 295 | 5 | 1 | 2 | 4.2 | N[C@H](COCc1cc(Cl)cc(Cl)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL92032 | 213884 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 295 | 5 | 1 | 2 | 4.2 | N[C@H](COCc1cc(Cl)cc(Cl)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
44346420 | 21077 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
CHEMBL119990 | 21077 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
107686 | 10152 | 41 | None | - | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
3522 | 10152 | 41 | None | - | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL131171 | 10152 | 41 | None | - | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
18782568 | 214061 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 321 | 3 | 1 | 3 | 4.0 | COc1ccccc1C1=CC2(CCCNC2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL93184 | 214061 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 321 | 3 | 1 | 3 | 4.0 | COc1ccccc1C1=CC2(CCCNC2c2ccccc2)OC1 | 10.1016/s0960-894x(02)00509-7 | |||
24784955 | 128858 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596467 | 128858 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 6.1 | N#Cc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL311405 | 217878 | 16 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
44305865 | 107460 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 582 | 10 | 3 | 6 | 2.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(CC(=O)O)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL292346 | 107460 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 582 | 10 | 3 | 6 | 2.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(CC(=O)O)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL2092883 | 215981 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | C[C@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
10258592 | 105983 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 639 | 7 | 0 | 4 | 6.8 | CS(=O)(=O)N1CC2(CCN(CCCC3(c4ccc(Cl)c(Cl)c4)CCCN(C(=O)c4ccccc4)C3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL281481 | 105983 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 639 | 7 | 0 | 4 | 6.8 | CS(=O)(=O)N1CC2(CCN(CCCC3(c4ccc(Cl)c(Cl)c4)CCCN(C(=O)c4ccccc4)C3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00215-7 | |||
44368172 | 128293 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 8 | 2 | 4 | 4.9 | FC(F)(F)c1cc(COC[C@@H](NCc2nc[nH]n2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL358409 | 128293 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 8 | 2 | 4 | 4.9 | FC(F)(F)c1cc(COC[C@@H](NCc2nc[nH]n2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(97)10163-9 | |||
10097954 | 138899 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 513 | 9 | 2 | 3 | 5.0 | CN(C)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
CHEMBL369601 | 138899 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 513 | 9 | 2 | 3 | 5.0 | CN(C)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00006a012 | |||
44287609 | 107137 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 503 | 6 | 0 | 5 | 5.4 | COc1ccccc1[C@H](SC)C(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL289666 | 107137 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 503 | 6 | 0 | 5 | 5.4 | COc1ccccc1[C@H](SC)C(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
24783681 | 128859 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596468 | 128859 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 443 | 6 | 1 | 2 | 6.4 | Fc1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44415458 | 87124 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.3 | FC(F)(F)c1cc(CO[C@H]2CC[C@@H](CN3CCCCC3)[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL214317 | 87124 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 7.3 | FC(F)(F)c1cc(CO[C@H]2CC[C@@H](CN3CCCCC3)[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.035 | |||
44415539 | 145757 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 474 | 5 | 1 | 2 | 5.8 | CN(C)C(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL378537 | 145757 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 474 | 5 | 1 | 2 | 5.8 | CN(C)C(=O)N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44305864 | 210276 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 525 | 8 | 3 | 5 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1[nH]nc2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL66193 | 210276 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 525 | 8 | 3 | 5 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1[nH]nc2ccccc12 | 10.1021/jm00039a022 | |||
44358519 | 37531 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 531 | 9 | 1 | 4 | 6.1 | CC(C)Oc1cccc(CC(=O)NCC(c2ccc(Cl)c(Cl)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
CHEMBL139569 | 37531 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 531 | 9 | 1 | 4 | 6.1 | CC(C)Oc1cccc(CC(=O)NCC(c2ccc(Cl)c(Cl)c2)N2CCC(N3CCCCC3)CC2)c1 | 10.1021/jm000986n | |||
44338584 | 14929 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 6.2 | FC(F)(F)c1cc(COCC(c2ccc(Cl)c(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL109183 | 14929 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 6.2 | FC(F)(F)c1cc(COCC(c2ccc(Cl)c(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
22353151 | 15903 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL109937 | 15903 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00563-2 | |||
44338618 | 116103 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL321892 | 116103 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
44346558 | 22160 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.0 | CN(C(=O)Cc1ccccc1)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
CHEMBL121459 | 22160 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 586 | 9 | 3 | 3 | 6.0 | CN(C(=O)Cc1ccccc1)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm9700171 | |||
24889114 | 14523 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 569 | 5 | 0 | 5 | 6.5 | Cc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089081 | 14523 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 569 | 5 | 0 | 5 | 6.5 | Cc1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
11743365 | 114165 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 429 | 4 | 0 | 4 | 4.6 | Cc1cc(C)cc(CN(C)C(=O)c2c(-c3ccc(F)cc3)c3cccnc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
CHEMBL317870 | 114165 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 429 | 4 | 0 | 4 | 4.6 | Cc1cc(C)cc(CN(C)C(=O)c2c(-c3ccc(F)cc3)c3cccnc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
44178113 | 68038 | 0 | None | -12 | 3 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766208 | 68038 | 0 | None | -12 | 3 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44274530 | 105709 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 549 | 7 | 0 | 4 | 7.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C(C)C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL279488 | 105709 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 549 | 7 | 0 | 4 | 7.5 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(C(C)C)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
24782655 | 128861 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596470 | 128861 | 0 | None | - | 0 | Mongolian jird | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1cccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44415486 | 87689 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 499 | 7 | 3 | 4 | 5.8 | Oc1nc(CN[C@@H]2CC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H]2c2ccccc2)c[nH]1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL215315 | 87689 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 499 | 7 | 3 | 4 | 5.8 | Oc1nc(CN[C@@H]2CC[C@H](OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H]2c2ccccc2)c[nH]1 | 10.1016/j.bmcl.2006.06.035 | |||
44358469 | 37917 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 629 | 11 | 3 | 5 | 5.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(Cl)c(Cl)c1)N1CCC(N(CCO)CCO)CC1 | 10.1021/jm000986n | |||
CHEMBL140023 | 37917 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 629 | 11 | 3 | 5 | 5.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccc(Cl)c(Cl)c1)N1CCC(N(CCO)CCO)CC1 | 10.1021/jm000986n | |||
10623791 | 37678 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 5.8 | CC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL139784 | 37678 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 459 | 5 | 0 | 2 | 5.8 | CC(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
71541572 | 94182 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 440 | 6 | 0 | 3 | 5.4 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3(F)CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333608 | 94182 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 440 | 6 | 0 | 3 | 5.4 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3(F)CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
71541573 | 94183 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3(F)CC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333609 | 94183 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 422 | 6 | 0 | 3 | 5.2 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3(F)CC3)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
22293463 | 108093 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 607 | 7 | 0 | 2 | 9.7 | CC(OC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL296629 | 108093 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 607 | 7 | 0 | 2 | 9.7 | CC(OC[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
44415412 | 85501 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 5.9 | COC(=O)N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL211257 | 85501 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 5.9 | COC(=O)N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
10553136 | 172103 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 491 | 10 | 2 | 5 | 2.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL423464 | 172103 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 491 | 10 | 2 | 5 | 2.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C)CC1)C(C)=O | 10.1021/jm950616c | |||
46884516 | 14598 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 567 | 5 | 0 | 4 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(C)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089533 | 14598 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 567 | 5 | 0 | 4 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(C)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44306036 | 20540 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 553 | 8 | 3 | 6 | 2.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL1195366 | 20540 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 553 | 8 | 3 | 6 | 2.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL554413 | 20540 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 553 | 8 | 3 | 6 | 2.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44306318 | 210564 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 8 | 2 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCCN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL68225 | 210564 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 8 | 2 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCCN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44358545 | 34212 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 541 | 7 | 1 | 3 | 6.1 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL136832 | 34212 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 541 | 7 | 1 | 3 | 6.1 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
9976640 | 203407 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1021/jm9700171 | |||
CHEMBL56427 | 203407 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1021/jm9700171 | |||
9976640 | 203407 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56427 | 203407 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 8 | 0 | 2 | 5.6 | Cc1cc(C)cc(COC[C@H](C(c2ccccc2)c2ccccc2)N(C)C)c1 | 10.1016/S0960-894X(01)80531-X | |||
44274170 | 83847 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccncc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL20736 | 83847 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3ccncc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
44274199 | 105534 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3cccnc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL278088 | 105534 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 563 | 7 | 1 | 4 | 7.1 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(-c3cccnc3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
10392469 | 201634 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL539928 | 201634 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 538 | 10 | 3 | 5 | 5.6 | C[C@H](NC(=O)[C@](Cc1c[nH]c2ccccc12)(CN(C)C)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
44370928 | 54530 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 619 | 18 | 1 | 4 | 7.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL154803 | 54530 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 619 | 18 | 1 | 4 | 7.1 | CCCCCN(CCCCC)C(=O)[C@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
10603392 | 64227 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 583 | 12 | 2 | 6 | 4.7 | CCOC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL165566 | 64227 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 583 | 12 | 2 | 6 | 4.7 | CCOC(=O)N(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
44274118 | 105730 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 473 | 6 | 1 | 3 | 5.8 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL279674 | 105730 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 473 | 6 | 1 | 3 | 5.8 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
57397019 | 78309 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 4 | 1 | 2 | 5.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1951617 | 78309 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 4 | 1 | 2 | 5.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.11.048 | |||
CHEMBL1962935 | 78309 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 4 | 1 | 2 | 5.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.11.048 | |||
46884519 | 14865 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 7.4 | Cc1noc(C)c1C1=CC(=O)N2C[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2C1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091342 | 14865 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 7.4 | Cc1noc(C)c1C1=CC(=O)N2C[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2C1 | 10.1016/j.bmcl.2010.01.120 | |||
24752434 | 15905 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
CHEMBL1099372 | 15905 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 491 | 4 | 1 | 3 | 5.1 | C[C@@H](O[C@H]1CN2C(=O)C(O)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.065 | |||
10743826 | 125364 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 6 | 0 | 3 | 5.2 | CS(=O)(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
CHEMBL341656 | 125364 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 6 | 0 | 3 | 5.2 | CS(=O)(=O)N1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1021/jm980376b | |||
44415484 | 175717 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL438789 | 175717 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44326361 | 118270 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 3 | 4.4 | CN(CC(N)=O)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL327765 | 118270 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 3 | 4.4 | CN(CC(N)=O)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
44326361 | 118270 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 3 | 4.4 | CN(CC(N)=O)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL327765 | 118270 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 3 | 4.4 | CN(CC(N)=O)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
9874168 | 212483 | 4 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL82386 | 212483 | 4 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
23025461 | 73226 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 400 | 6 | 1 | 4 | 4.5 | COc1ccc(N)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852063 | 73226 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 400 | 6 | 1 | 4 | 4.5 | COc1ccc(N)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL3216952 | 73226 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 400 | 6 | 1 | 4 | 4.5 | COc1ccc(N)cc1CN1CCC(=O)C(C(c2ccccc2)c2ccccc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
9805809 | 109864 | 8 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
CHEMBL307488 | 109864 | 8 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 8 | 3 | 4 | 6.0 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cc2ccccc2o1)c1ccccc1 | 10.1021/jm010825z | |||
11844212 | 105425 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 590 | 7 | 1 | 2 | 7.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC2(C=Cc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm060439n | |||
CHEMBL277279 | 105425 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 590 | 7 | 1 | 2 | 7.7 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC2(C=Cc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm060439n | |||
44348667 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL124542 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL333069 | 121105 | 1 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 439 | 0 | 1 | 4 | 5.2 | C#C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
44338652 | 115387 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL320544 | 115387 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00563-2 | |||
44322736 | 213780 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 6 | 1 | 2 | 6.1 | Fc1ccc(N(CCCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)cc1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL91436 | 213780 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 6 | 1 | 2 | 6.1 | Fc1ccc(N(CCCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)cc1 | 10.1016/s0960-894x(01)00727-2 | |||
44233185 | 201601 | 0 | None | -181 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL539193 | 201601 | 0 | None | -181 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL5083565 | 221650 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | C[C@@H](O[C@H]1O[C@@H]2CC[C@@H](c3ccccc3)O[C@@H]2[C@H](O)[C@H]1OCc1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00793 | |||||
44458789 | 148591 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1668 | 41 | 14 | 16 | 4.5 | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C(Cl)C(Cl)CN1C(=O)[C@H](C)NC(=O)[C@@H]1C(c2cccnc2)CCN1C(=O)[C@H](CCCCN)NC(=O)c1cccnc1)C(=O)O | 10.1021/jm00109a034 | |||
CHEMBL386306 | 148591 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1668 | 41 | 14 | 16 | 4.5 | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C(Cl)C(Cl)CN1C(=O)[C@H](C)NC(=O)[C@@H]1C(c2cccnc2)CCN1C(=O)[C@H](CCCCN)NC(=O)c1cccnc1)C(=O)O | 10.1021/jm00109a034 | |||
44458351 | 106166 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL282657 | 106166 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 443 | 5 | 0 | 2 | 5.9 | FC(F)(F)c1cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL410808 | 219622 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(c1ccccc1)c1ccccc1)C(N)=O | 10.1021/jm00037a009 | |||||
15755314 | 108975 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 711 | 17 | 4 | 9 | 3.4 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL302843 | 108975 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 711 | 17 | 4 | 9 | 3.4 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCCc1ccccc1 | 10.1021/jm00089a011 | |||
44458789 | 148591 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1668 | 41 | 14 | 16 | 4.5 | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C(Cl)C(Cl)CN1C(=O)[C@H](C)NC(=O)[C@@H]1C(c2cccnc2)CCN1C(=O)[C@H](CCCCN)NC(=O)c1cccnc1)C(=O)O | 10.1021/jm00085a015 | |||
CHEMBL386306 | 148591 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1668 | 41 | 14 | 16 | 4.5 | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C(Cl)C(Cl)CN1C(=O)[C@H](C)NC(=O)[C@@H]1C(c2cccnc2)CCN1C(=O)[C@H](CCCCN)NC(=O)c1cccnc1)C(=O)O | 10.1021/jm00085a015 | |||
18655106 | 207248 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 464 | 10 | 0 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL59854 | 207248 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 464 | 10 | 0 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1016/S0960-894X(01)80747-2 | |||
44287443 | 107048 | 1 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 528 | 9 | 0 | 5 | 4.9 | CN(C)CCCOc1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL288942 | 107048 | 1 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 528 | 9 | 0 | 5 | 4.9 | CN(C)CCCOc1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
10697072 | 62587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 511 | 11 | 3 | 5 | 3.8 | COc1ccccc1CNCC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL162288 | 62587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 511 | 11 | 3 | 5 | 3.8 | COc1ccccc1CNCC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00085a015 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00085a015 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00085a015 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00085a015 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00085a015 | |||
44318310 | 212437 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc(C2NCCOC23CCC(c2cccc(C(F)(F)F)c2)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL81986 | 212437 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc(C2NCCOC23CCC(c2cccc(C(F)(F)F)c2)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
44333682 | 11394 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 619 | 6 | 1 | 3 | 7.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2cc(Br)cc(Br)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL102887 | 11394 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 619 | 6 | 1 | 3 | 7.4 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2cc(Br)cc(Br)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
11490127 | 98859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 5 | 0 | 2 | 8.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CBr)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL24194 | 98859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 5 | 0 | 2 | 8.1 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CBr)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
12225557 | 127955 | 1 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL357717 | 127955 | 1 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 382 | 6 | 1 | 2 | 5.1 | c1ccc(CN[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(01)81197-5 | |||
24801792 | 94219 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccccc2F)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333644 | 94219 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(Cl)n2)(c2ccccc2F)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
54582296 | 67928 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 5 | 0 | 2 | 6.8 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)ccnc1CCl | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765498 | 67928 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 5 | 0 | 2 | 6.8 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)ccnc1CCl | 10.1016/j.bmc.2011.02.031 | |||
10473960 | 93057 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm9700171 | |||
CHEMBL23129 | 93057 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm9700171 | |||
44177570 | 68034 | 0 | None | -169 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766204 | 68034 | 0 | None | -169 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
68932301 | 131570 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 4 | 0 | 4 | 4.9 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Br)cn3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642169 | 131570 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 4 | 0 | 4 | 4.9 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Br)cn3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
44288795 | 175051 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 467 | 6 | 3 | 5 | 4.7 | O=C(c1cc(O)cc(O)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL43394 | 175051 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 467 | 6 | 3 | 5 | 4.7 | O=C(c1cc(O)cc(O)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10917690 | 214384 | 1 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1021/jm058225d | |||
CHEMBL95051 | 214384 | 1 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1021/jm058225d | |||
44286718 | 174506 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL43027 | 174506 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 437 | 5 | 1 | 1 | 6.2 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
44383969 | 135824 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL367034 | 135824 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
44383969 | 135824 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
CHEMBL367034 | 135824 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1cccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00006a012 | |||
54585202 | 67929 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 536 | 5 | 1 | 4 | 5.8 | Cc1nc(N2CCN(C)CC2)cc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765499 | 67929 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 536 | 5 | 1 | 4 | 5.8 | Cc1nc(N2CCN(C)CC2)cc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
54585205 | 67938 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.0 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nncn12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765506 | 67938 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 492 | 4 | 0 | 4 | 6.0 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nncn12 | 10.1016/j.bmc.2011.02.031 | |||
46884432 | 14694 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 5 | 0 | 3 | 7.7 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(C#N)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090285 | 14694 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 5 | 0 | 3 | 7.7 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(C#N)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44297602 | 202021 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 614 | 9 | 1 | 5 | 4.9 | CN(Cc1ccc(Cl)c(Cl)c1)CC(NCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL55098 | 202021 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 614 | 9 | 1 | 5 | 4.9 | CN(Cc1ccc(Cl)c(Cl)c1)CC(NCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL2114442 | 216033 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)[C@@H]1CCc2ccccc21)C(N)=O | 10.1021/jm00037a009 | |||||
24783683 | 128856 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 455 | 7 | 1 | 3 | 6.2 | COc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596465 | 128856 | 0 | None | - | 0 | Mongolian jird | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 455 | 7 | 1 | 3 | 6.2 | COc1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
24889111 | 14696 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 656 | 7 | 1 | 4 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(NS(C)(=O)=O)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090287 | 14696 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 656 | 7 | 1 | 4 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccc(NS(C)(=O)=O)cc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
10370593 | 13035 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 7.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL108164 | 13035 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 4 | 1 | 3 | 7.5 | Cc1cc2c(-c3ccccc3)c(NC(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
44288976 | 170010 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1cccc(Cl)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL418438 | 170010 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 469 | 6 | 1 | 3 | 5.9 | O=C(c1cccc(Cl)c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10349900 | 113526 | 0 | None | 39 | 3 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144343 | 113526 | 0 | None | 39 | 3 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 716 | 13 | 3 | 7 | 2.8 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44312887 | 109714 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 626 | 14 | 6 | 6 | 1.4 | C[C@@H](O)C(NC(=O)CC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(N)=O | 10.1021/jm00068a003 | |||
CHEMBL306267 | 109714 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 626 | 14 | 6 | 6 | 1.4 | C[C@@H](O)C(NC(=O)CC(NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(N)=O | 10.1021/jm00068a003 | |||
24782658 | 128851 | 0 | None | - | 0 | Mongolian jird | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 475 | 6 | 1 | 2 | 7.4 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2cccc3ccccc23)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596460 | 128851 | 0 | None | - | 0 | Mongolian jird | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 475 | 6 | 1 | 2 | 7.4 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2cccc3ccccc23)c1 | 10.1016/j.bmcl.2015.04.098 | |||
22851562 | 173232 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL42778 | 173232 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
44297451 | 107436 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccccc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL292211 | 107436 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccccc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
16755232 | 180367 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 514 | 4 | 1 | 4 | 6.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL453314 | 180367 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 514 | 4 | 1 | 4 | 6.5 | O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(-c2ccccc2)c2ccccc2n2cnnc12 | 10.1016/j.bmc.2008.05.067 | |||
21308488 | 108280 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 603 | 12 | 1 | 5 | 5.4 | CS(=O)(=O)N(CC1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1)c1ccccc1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL297957 | 108280 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 603 | 12 | 1 | 5 | 5.4 | CS(=O)(=O)N(CC1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1)c1ccccc1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL2369601 | 216414 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm960281e | |||||
10043484 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm9700171 | |||
CHEMBL23715 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm9700171 | |||
44334006 | 114393 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(CO)(c3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
CHEMBL318989 | 114393 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 6.6 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(CO)(c3ccccc3)CC2)c2cc(Cl)ccc21 | 10.1016/s0960-894x(01)00616-3 | |||
44297513 | 108382 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 547 | 9 | 1 | 5 | 4.0 | Cc1cccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)c1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL298772 | 108382 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 547 | 9 | 1 | 5 | 4.0 | Cc1cccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)c1 | 10.1016/s0960-894x(98)00320-5 | |||
10499624 | 123412 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 337 | 5 | 1 | 2 | 4.8 | CC(C)(C)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL336931 | 123412 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 337 | 5 | 1 | 2 | 4.8 | CC(C)(C)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
44308930 | 211106 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL71498 | 211106 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
44308930 | 211106 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL71498 | 211106 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 255 | 5 | 1 | 2 | 3.5 | Cc1cc(C)cc(COC[C@@H](N)c2ccccc2)c1 | 10.1016/0960-894X(95)00476-A | |||
44299916 | 202581 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 387 | 9 | 1 | 2 | 6.0 | Cc1cc(C)cc(COCC(NC(C)C)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL55796 | 202581 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 387 | 9 | 1 | 2 | 6.0 | Cc1cc(C)cc(COCC(NC(C)C)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
9869033 | 107200 | 5 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL290364 | 107200 | 5 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
56675290 | 73223 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1OC | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817884 | 73223 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1OC | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852032 | 73223 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1cccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c1OC | 10.1016/j.bmc.2011.07.014 | |||
16755257 | 180165 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 4 | 0 | 5 | 6.6 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3nnnn3c3ccccc23)cc1 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL452794 | 180165 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 4 | 0 | 5 | 6.6 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3nnnn3c3ccccc23)cc1 | 10.1016/j.bmc.2008.05.067 | |||
44324532 | 213622 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 578 | 14 | 1 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL90547 | 213622 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 578 | 14 | 1 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
15755319 | 107457 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 669 | 15 | 5 | 7 | 3.8 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL292320 | 107457 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 669 | 15 | 5 | 7 | 3.8 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
10410206 | 86359 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
CHEMBL2114308 | 86359 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 426 | 7 | 2 | 3 | 4.9 | Cc1cc(C)cc(COC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
10410322 | 106179 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 428 | 8 | 2 | 4 | 4.3 | COc1ccc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)cc1 | 10.1021/jm00035a006 | |||
CHEMBL282728 | 106179 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 428 | 8 | 2 | 4 | 4.3 | COc1ccc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)cc1 | 10.1021/jm00035a006 | |||
10043484 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23715 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm00035a006 | |||
10043484 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm00066a015 | |||
CHEMBL23715 | 96240 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 4.0 | Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C)c1 | 10.1021/jm00066a015 | |||
44297931 | 199493 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 9 | 1 | 4 | 5.3 | Cc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL52198 | 199493 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 9 | 1 | 4 | 5.3 | Cc1ccccc1N1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
44287191 | 164460 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL40817 | 164460 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 465 | 6 | 0 | 1 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
44275987 | 106120 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
CHEMBL282331 | 106120 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
19797477 | 45438 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL146552 | 45438 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.5 | COc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
9984184 | 211428 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 6 | 2 | 2 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL73618 | 211428 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 6 | 2 | 2 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
44383681 | 173048 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 430 | 6 | 1 | 2 | 6.1 | Clc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
CHEMBL426939 | 173048 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 430 | 6 | 1 | 2 | 6.1 | Clc1ccccc1CN[C@H]1C2CCCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80693-9 | |||
10411026 | 68130 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 5.2 | FC(F)(F)c1cc(CN2CCNC(Cc3c[nH]c4ccccc34)C2)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
CHEMBL176772 | 68130 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 5.2 | FC(F)(F)c1cc(CN2CCNC(Cc3c[nH]c4ccccc34)C2)cc(C(F)(F)F)c1 | 10.1021/jm00006a011 | |||
44319341 | 212669 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 572 | 10 | 1 | 7 | 3.8 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3cccnc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL83885 | 212669 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 572 | 10 | 1 | 7 | 3.8 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3cccnc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44297493 | 169928 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1ccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)cc1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL417914 | 169928 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1ccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)cc1 | 10.1016/s0960-894x(98)00320-5 | |||
10620143 | 106038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL281828 | 106038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
54582297 | 67936 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 493 | 4 | 0 | 5 | 5.4 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nnnn12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765504 | 67936 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 493 | 4 | 0 | 5 | 5.4 | Cc1c(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nnnn12 | 10.1016/j.bmc.2011.02.031 | |||
71583092 | 95000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.1 | O=C1CC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CCN1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347703 | 95000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.1 | O=C1CC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CCN1 | 10.1016/j.bmc.2013.02.010 | |||
44324527 | 113315 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 550 | 13 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL314084 | 113315 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 550 | 13 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN)C1 | 10.1016/S0960-894X(01)80747-2 | |||
10620143 | 106038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm9700171 | |||
CHEMBL281828 | 106038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm9700171 | |||
44274242 | 105927 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 541 | 6 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cc(Cl)cc(Cl)c23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL281149 | 105927 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 541 | 6 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cc(Cl)cc(Cl)c23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
10553958 | 108146 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
CHEMBL297068 | 108146 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(00)80046-3 | |||
CHEMBL5076397 | 221214 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | O[C@H]1COC[C@H]1N1CC[C@@H](c2cc3nc(Nc4cnn([C@@H]5CC5(F)F)c4Cl)ncc3cc2Cl)[C@H](F)C1 | 10.1021/acs.jmedchem.1c01968 | |||||
10553958 | 108146 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
CHEMBL297068 | 108146 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 519 | 6 | 0 | 2 | 7.5 | FC(F)(F)c1cc(CO[C@@H]2C3CCN(CC3)[C@@H]2C(c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm9700171 | |||
44297469 | 108558 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL300005 | 108558 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44328545 | 214431 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 456 | 6 | 1 | 2 | 6.6 | Clc1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL95270 | 214431 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 456 | 6 | 1 | 2 | 6.6 | Clc1ccccc1CNC1C2CC3CCCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL1196922 | 215375 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | None | None | None | N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00089a011 | |||||
CHEMBL558620 | 215375 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | None | None | None | N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00089a011 | |||||
10692651 | 107866 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
CHEMBL294960 | 107866 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.9 | FC(F)(F)c1cc(CO[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1021/jm950654w | |||
44294261 | 86483 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 593 | 7 | 0 | 2 | 9.1 | Fc1ccc(C2CCN([C@H]3CC[C@@](COCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115454 | 86483 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 593 | 7 | 0 | 2 | 9.1 | Fc1ccc(C2CCN([C@H]3CC[C@@](COCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2112241 | 216007 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | COc1ccc(C[C@@H]2NC(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)NC(=O)[C@H]([C@@H](C)O)NC2=O)cc1 | 10.1021/jm960281e | |||||
44375315 | 63281 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL163510 | 63281 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
10530317 | 12000 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 532 | 9 | 2 | 3 | 4.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL106239 | 12000 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 532 | 9 | 2 | 3 | 4.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)NCc1ccccc1Cl | 10.1021/jm970499g | |||
44286754 | 169923 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 7 | 1 | 1 | 6.6 | O=C(NCCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL417881 | 169923 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 7 | 1 | 1 | 6.6 | O=C(NCCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
104974 | 10248 | 31 | None | -1202 | 7 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
2111 | 10248 | 31 | None | -1202 | 7 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
3481 | 10248 | 31 | None | -1202 | 7 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL308148 | 10248 | 31 | None | -1202 | 7 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
DB06660 | 10248 | 31 | None | -1202 | 7 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL2369604 | 216416 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CO)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
44324531 | 213534 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 13 | 2 | 4 | 4.9 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCC(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL90035 | 213534 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 13 | 2 | 4 | 4.9 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCC(=O)O)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44433803 | 153572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392465 | 153572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 654 | 5 | 0 | 5 | 6.8 | CC(=O)N1CCC(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](c3noc(C(C)(C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3)C2)CC1 | 10.1016/j.bmcl.2007.08.028 | |||
44289934 | 108036 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 529 | 12 | 2 | 4 | 5.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)c1ccc(F)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL296216 | 108036 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 529 | 12 | 2 | 4 | 5.1 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)c1ccc(F)cc1)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
44358672 | 126136 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 541 | 7 | 0 | 5 | 4.9 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1ccccc1Br | 10.1021/jm000986n | |||
CHEMBL344378 | 126136 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 541 | 7 | 0 | 5 | 4.9 | CN(CC(c1cccc2c1OCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1ccccc1Br | 10.1021/jm000986n | |||
21121353 | 108250 | 0 | None | 19 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | |||
CHEMBL297776 | 108250 | 0 | None | 19 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 625 | 14 | 4 | 7 | 2.0 | CC(=O)N[C@H](C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1)C(C)O | 10.1021/jm00063a015 | |||
71452678 | 85352 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 591 | 5 | 2 | 3 | 6.4 | Cc1ccc(-c2ccc(C(=O)N[C@@H]3CCCCNC3=O)cc2N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL2112211 | 85352 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 591 | 5 | 2 | 3 | 6.4 | Cc1ccc(-c2ccc(C(=O)N[C@@H]3CCCCNC3=O)cc2N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 | 10.1016/s0960-894x(02)00382-7 | |||
9868530 | 84107 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL20837 | 84107 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
24800398 | 94185 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 450 | 6 | 0 | 3 | 6.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CCCC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333610 | 94185 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 450 | 6 | 0 | 3 | 6.1 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CCCC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
56678486 | 73243 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | N#Cc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817837 | 73243 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | N#Cc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852157 | 73243 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 416 | 5 | 0 | 3 | 5.1 | N#Cc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
9874168 | 212483 | 4 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL82386 | 212483 | 4 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
44408144 | 82042 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 498 | 4 | 0 | 2 | 6.4 | CN(C)[C@H]1CC[C@](c2ccccc2)(N2CCC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2=O)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
CHEMBL203700 | 82042 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 498 | 4 | 0 | 2 | 6.4 | CN(C)[C@H]1CC[C@](c2ccccc2)(N2CCC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2=O)CC1 | 10.1016/j.bmcl.2005.11.111 | |||
44415411 | 145563 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 475 | 5 | 0 | 3 | 6.3 | COC(=O)N(C)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL378076 | 145563 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 475 | 5 | 0 | 3 | 6.3 | COC(=O)N(C)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
2755911 | 82214 | 52 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL2042018 | 82214 | 52 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
44274104 | 87335 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 571 | 7 | 1 | 5 | 5.9 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(N3CCOCC3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21489 | 87335 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 571 | 7 | 1 | 5 | 5.9 | Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)N2CCC(O)(Cc3ccccc3)CC2)c2cc(N3CCOCC3)ccc21 | 10.1016/s0960-894x(01)00182-2 | |||
18669089 | 105715 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 509 | 6 | 1 | 3 | 6.7 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)(C)C)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL279523 | 105715 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 509 | 6 | 1 | 3 | 6.7 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(C(C)(C)C)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
24799187 | 94201 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 449 | 6 | 0 | 4 | 4.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CC=CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333626 | 94201 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 449 | 6 | 0 | 4 | 4.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(N3CC=CC3)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
22293526 | 86406 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.4 | O=C(NC[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115008 | 86406 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.4 | O=C(NC[C@]1(c2ccccc2)CC[C@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00249-4 | |||
24785443 | 128846 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 425 | 6 | 1 | 2 | 6.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596455 | 128846 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 425 | 6 | 1 | 2 | 6.2 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccc2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44338586 | 13657 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL108422 | 13657 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
71541577 | 94189 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 438 | 6 | 0 | 3 | 5.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2cccc(Cl)c2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333614 | 94189 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 438 | 6 | 0 | 3 | 5.8 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3)n2)(c2cccc(Cl)c2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
46884518 | 14750 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 554 | 5 | 0 | 4 | 6.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ncco3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090547 | 14750 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 554 | 5 | 0 | 4 | 6.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ncco3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44306436 | 107779 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 538 | 8 | 2 | 5 | 3.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL294370 | 107779 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 538 | 8 | 2 | 5 | 3.1 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
44335360 | 11637 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 608 | 8 | 2 | 4 | 5.5 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00631-x | |||
CHEMBL104348 | 11637 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 608 | 8 | 2 | 4 | 5.5 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CCC(=O)N[C@@H]1CCCCNC1=O)Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00631-x | |||
44358427 | 37787 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 643 | 7 | 1 | 3 | 8.0 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cc(Cl)cc(Cl)c1Cl)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139903 | 37787 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 643 | 7 | 1 | 3 | 8.0 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(c1cc(Cl)cc(Cl)c1Cl)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44325096 | 118309 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 323 | 3 | 1 | 3 | 4.1 | COc1ccccc1[C@H]1COC2(CCCNC2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
CHEMBL327928 | 118309 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 323 | 3 | 1 | 3 | 4.1 | COc1ccccc1[C@H]1COC2(CCCNC2c2ccccc2)C1 | 10.1016/s0960-894x(02)00509-7 | |||
58993609 | 128855 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596464 | 128855 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 470 | 7 | 1 | 4 | 6.1 | O=[N+]([O-])c1ccccc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
40727876 | 122971 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 417 | 7 | 3 | 4 | 3.0 | O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1ccccc1)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL3358423 | 122971 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 417 | 7 | 3 | 4 | 3.0 | O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1ccccc1)OCc1ccccc1 | 10.1021/ml5002954 | |||
44297642 | 202229 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)cc3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL55240 | 202229 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3ccc(Cl)cc3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
53379507 | 73227 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817829 | 73227 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852067 | 73227 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccccc1CN1CCC(=O)C(C(c2ccc(F)cc2)c2ccc(F)cc2)C1 | 10.1016/j.bmc.2011.07.014 | |||
10390130 | 106017 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 474 | 6 | 2 | 2 | 5.9 | NC(=O)NC[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL281717 | 106017 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 474 | 6 | 2 | 2 | 5.9 | NC(=O)NC[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00220-N | |||
11619202 | 94998 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 6.3 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347697 | 94998 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 6.3 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
107686 | 10152 | 41 | None | 15 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
3522 | 10152 | 41 | None | 15 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL131171 | 10152 | 41 | None | 15 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
44299943 | 202341 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 359 | 8 | 1 | 2 | 5.2 | CNC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL55476 | 202341 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 359 | 8 | 1 | 2 | 5.2 | CNC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
10602065 | 42171 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 521 | 8 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(CCc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL143775 | 42171 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 521 | 8 | 0 | 2 | 7.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(CCc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
44358670 | 36745 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 545 | 7 | 1 | 5 | 4.9 | CC(C)N1CCN(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cccc3c2OCO3)CC1 | 10.1021/jm000986n | |||
CHEMBL138853 | 36745 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 545 | 7 | 1 | 5 | 4.9 | CC(C)N1CCN(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cccc3c2OCO3)CC1 | 10.1021/jm000986n | |||
44297463 | 169898 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 611 | 9 | 1 | 5 | 4.5 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Br)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL417731 | 169898 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 611 | 9 | 1 | 5 | 4.5 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cccc(Br)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10327540 | 170284 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 720 | 21 | 2 | 7 | 7.5 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm960281e | |||
CHEMBL420221 | 170284 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 720 | 21 | 2 | 7 | 7.5 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm960281e | |||
44289219 | 169082 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 480 | 6 | 1 | 2 | 5.6 | O=C(Cc1ccccc1)N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL416436 | 169082 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 480 | 6 | 1 | 2 | 5.6 | O=C(Cc1ccccc1)N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
118722857 | 122969 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 376 | 7 | 2 | 5 | 1.6 | CS(=O)(=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL3358421 | 122969 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 376 | 7 | 2 | 5 | 1.6 | CS(=O)(=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
44333606 | 11921 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 7.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)cc2Cl)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL105800 | 11921 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 7.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)cc2Cl)c1 | 10.1016/S0960-894X(96)00563-X | |||
10342797 | 97664 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1Cl)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL23927 | 97664 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 7 | 2 | 3 | 4.9 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1Cl)c1ccccc1 | 10.1021/jm00035a006 | |||
24800925 | 94220 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 360 | 5 | 1 | 3 | 3.7 | Brc1cncc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333645 | 94220 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 360 | 5 | 1 | 3 | 3.7 | Brc1cncc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL405795 | 219360 | 7 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | None | None | None | NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a011 | |||||
10458786 | 12195 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 504 | 5 | 0 | 3 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL107283 | 12195 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 504 | 5 | 0 | 3 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
44288934 | 161870 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 599 | 6 | 0 | 3 | 7.3 | O=C(c1cc(Cl)cc(Cl)c1)N1CC[C@H](N(Cc2ccnc3ccccc23)C(=O)C(F)(F)F)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL40189 | 161870 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 599 | 6 | 0 | 3 | 7.3 | O=C(c1cc(Cl)cc(Cl)c1)N1CC[C@H](N(Cc2ccnc3ccccc23)C(=O)C(F)(F)F)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10087358 | 67114 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 320 | 4 | 1 | 3 | 3.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccccc1 | 10.1021/jm00006a011 | |||
CHEMBL174465 | 67114 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 320 | 4 | 1 | 3 | 3.3 | O=C1OC(Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccccc1 | 10.1021/jm00006a011 | |||
21308490 | 108424 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 522 | 8 | 1 | 3 | 6.2 | O=C([C@H](COCc1ccc(Cl)c(Cl)c1)NCc1ccccc1)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL299089 | 108424 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 522 | 8 | 1 | 3 | 6.2 | O=C([C@H](COCc1ccc(Cl)c(Cl)c1)NCc1ccccc1)N1CCC2(CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00319-9 | |||
44346675 | 121032 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 320 | 4 | 1 | 3 | 3.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL333039 | 121032 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 320 | 4 | 1 | 3 | 3.3 | O=C1O[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccccc1 | 10.1021/jm9700171 | |||
44337704 | 174913 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 578 | 9 | 3 | 5 | 4.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=N)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL432979 | 174913 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 578 | 9 | 3 | 5 | 4.9 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=N)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
44297859 | 108494 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 11 | 1 | 5 | 5.5 | CN(c1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1)S(C)(=O)=O | 10.1016/s0960-894x(98)00319-9 | |||
CHEMBL299528 | 108494 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 11 | 1 | 5 | 5.5 | CN(c1ccccc1C1CCN(C(=O)[C@H](COCc2ccc(Cl)c(Cl)c2)NCc2ccccc2)CC1)S(C)(=O)=O | 10.1016/s0960-894x(98)00319-9 | |||
21994329 | 35694 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1cc(C)cc(C)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL137972 | 35694 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1cc(C)cc(C)c1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL2112246 | 216012 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
11724403 | 175324 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL435564 | 175324 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C\c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
10389807 | 103385 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cccc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL26336 | 103385 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 466 | 7 | 2 | 3 | 5.3 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cccc(C(F)(F)F)c1)c1ccccc1 | 10.1021/jm00035a006 | |||
CHEMBL411230 | 219653 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
44433785 | 153687 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 526 | 6 | 0 | 2 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(CC2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL392566 | 153687 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 526 | 6 | 0 | 2 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CN(CC2CCCCC2)C[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2007.08.028 | |||
68870858 | 131569 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C4CC4)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642168 | 131569 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 5.6 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C4CC4)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
18391053 | 173358 | 1 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 5 | 2 | 3 | 4.0 | NCC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL42800 | 173358 | 1 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 5 | 2 | 3 | 4.0 | NCC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
19797458 | 40999 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL142638 | 40999 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1cccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
19797415 | 45015 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 475 | 8 | 0 | 3 | 7.3 | c1ccc(Oc2cccc(COC3C4CCN(CC4)C3C(c3ccccc3)c3ccccc3)c2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL146223 | 45015 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 475 | 8 | 0 | 3 | 7.3 | c1ccc(Oc2cccc(COC3C4CCN(CC4)C3C(c3ccccc3)c3ccccc3)c2)cc1 | 10.1021/jm00024a007 | |||
44287481 | 169761 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 479 | 8 | 1 | 1 | 7.0 | O=C(CC(c1ccccc1)c1ccccc1)NCCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL417522 | 169761 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 479 | 8 | 1 | 1 | 7.0 | O=C(CC(c1ccccc1)c1ccccc1)NCCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(96)00280-6 | |||
10650263 | 32859 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
CHEMBL135572 | 32859 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 547 | 4 | 0 | 4 | 6.8 | Cc1ccc(-c2c(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm980042m | |||
44345147 | 118076 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2\CCC(NC(=O)c3ccnc4ccccc34)CC2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL326613 | 118076 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2\CCC(NC(=O)c3ccnc4ccccc34)CC2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
44297649 | 195491 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 9 | 1 | 6 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](CS(=O)(=O)Cc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL50455 | 195491 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 9 | 1 | 6 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](CS(=O)(=O)Cc3ccc(Cl)c(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
10052114 | 172862 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 512 | 4 | 2 | 3 | 4.9 | CNC(=O)N1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1Cc1c[nH]c2ccccc12 | 10.1021/jm00006a011 | |||
CHEMBL425848 | 172862 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 512 | 4 | 2 | 3 | 4.9 | CNC(=O)N1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1Cc1c[nH]c2ccccc12 | 10.1021/jm00006a011 | |||
10837320 | 42221 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 415 | 5 | 1 | 1 | 6.4 | FC(F)(F)c1cc(CCCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL143813 | 42221 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 415 | 5 | 1 | 1 | 6.4 | FC(F)(F)c1cc(CCCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL265573 | 217433 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)/C(=C\c1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
44384901 | 176683 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL444086 | 176683 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc1 | 10.1016/0960-894X(96)00148-5 | |||
44384986 | 136552 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 623 | 9 | 1 | 5 | 6.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1C | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL367528 | 136552 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 623 | 9 | 1 | 5 | 6.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1C | 10.1016/0960-894X(96)00148-5 | |||
44411637 | 146058 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 441 | 4 | 1 | 3 | 4.5 | O=C(CC1CCN(C(=O)c2cccc(C#Cc3ccccn3)c2)CC1)Nc1ccccc1F | 10.1016/j.bmcl.2006.02.027 | |||
CHEMBL379097 | 146058 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 441 | 4 | 1 | 3 | 4.5 | O=C(CC1CCN(C(=O)c2cccc(C#Cc3ccccn3)c2)CC1)Nc1ccccc1F | 10.1016/j.bmcl.2006.02.027 | |||
44344195 | 170139 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 475 | 5 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2C3CC(NCc4ccnc5ccccc45)CC2C(c2ccccc2)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
CHEMBL419232 | 170139 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 475 | 5 | 1 | 3 | 6.2 | Cc1cc(C)cc(C(=O)N2C3CC(NCc4ccnc5ccccc45)CC2C(c2ccccc2)C3)c1 | 10.1016/S0960-894X(96)00623-3 | |||
10055415 | 113533 | 0 | None | - | 3 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144352 | 113533 | 0 | None | - | 3 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 688 | 12 | 4 | 5 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL418757 | 220018 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm9800346 | |||||
58993550 | 128844 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.7 | Cn1nnnc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596453 | 128844 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 431 | 6 | 1 | 6 | 3.7 | Cn1nnnc1-c1cc(COCC2(c3ccccc3)CCNCC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44384677 | 138236 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC(C)C | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL369174 | 138236 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC(C)C | 10.1016/0960-894X(96)00148-5 | |||
44413144 | 145997 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 8 | 2 | 3 | 4.4 | CN(C)CCN[C@H](C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.04.045 | |||
CHEMBL378784 | 145997 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 8 | 2 | 3 | 4.4 | CN(C)CCN[C@H](C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.04.045 | |||
54582277 | 67921 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 438 | 4 | 1 | 2 | 6.0 | Cc1nccc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765491 | 67921 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 438 | 4 | 1 | 2 | 6.0 | Cc1nccc(-c2ccccc2)c1C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
28558057 | 169828 | 2 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 423 | 4 | 1 | 1 | 6.5 | O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
CHEMBL41762 | 169828 | 2 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 423 | 4 | 1 | 1 | 6.5 | O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(96)00280-6 | |||
24801627 | 94191 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 5 | 0 | 3 | 4.9 | CN1CCC(COCc2cc(Cl)cc(C(F)(F)F)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333616 | 94191 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 5 | 0 | 3 | 4.9 | CN1CCC(COCc2cc(Cl)cc(C(F)(F)F)n2)(c2ccccc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
10695397 | 196384 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 6 | 1 | 4 | 4.7 | O=C(O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
CHEMBL51477 | 196384 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 6 | 1 | 4 | 4.7 | O=C(O)CN1CCO[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1021/jm950654w | |||
46884517 | 14864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 643 | 7 | 0 | 4 | 8.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(Cc4ccccc4)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091341 | 14864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 643 | 7 | 0 | 4 | 8.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cnn(Cc4ccccc4)c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
10026200 | 11620 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 439 | 5 | 1 | 3 | 5.9 | CCN(Cc1ccccc1)C(=O)Nc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL104277 | 11620 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 439 | 5 | 1 | 3 | 5.9 | CCN(Cc1ccccc1)C(=O)Nc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
44385575 | 66570 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 653 | 11 | 1 | 6 | 5.6 | COc1cc(CC(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL172676 | 66570 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 653 | 11 | 1 | 6 | 5.6 | COc1cc(CC(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/0960-894X(96)00148-5 | |||
71583203 | 94996 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347695 | 94996 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmc.2013.02.010 | |||
10473960 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00006a012 | |||
CHEMBL23129 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00006a012 | |||
10473960 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23129 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
44415423 | 146032 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 5 | 1 | 2 | 5.9 | O=C(O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL378984 | 146032 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 5 | 1 | 2 | 5.9 | O=C(O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
71699787 | 131558 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 593 | 4 | 0 | 3 | 5.5 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Br)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642157 | 131558 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 593 | 4 | 0 | 3 | 5.5 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Br)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
19797468 | 44530 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL145801 | 44530 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.5 | FC(F)(F)c1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
19003156 | 73915 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm0311487 | |||
CHEMBL187554 | 73915 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm0311487 | |||
10473960 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00066a015 | |||
CHEMBL23129 | 93057 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 364 | 6 | 2 | 3 | 3.6 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00066a015 | |||
15639109 | 170813 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 1 | 2 | 5.6 | c1ccc(CN[C@H]2C3CC4CCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL420876 | 170813 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 1 | 2 | 5.6 | c1ccc(CN[C@H]2C3CC4CCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
44321046 | 213000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 7 | 2 | 3 | 5.1 | CNc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL86643 | 213000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 7 | 2 | 3 | 5.1 | CNc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44321046 | 213000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 7 | 2 | 3 | 5.1 | CNc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
CHEMBL86643 | 213000 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 7 | 2 | 3 | 5.1 | CNc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00092a009 | |||
44321493 | 213018 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 480 | 7 | 1 | 3 | 6.4 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1021/jm00092a009 | |||
CHEMBL86746 | 213018 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 480 | 7 | 1 | 3 | 6.4 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1021/jm00092a009 | |||
10451098 | 18578 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 359 | 4 | 2 | 1 | 4.5 | O=C(NCc1c[nH]c2ccccc12)N1C2CCC(C2)C1Cc1ccccc1 | 10.1016/S0960-894X(96)00570-7 | |||
CHEMBL118194 | 18578 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 359 | 4 | 2 | 1 | 4.5 | O=C(NCc1c[nH]c2ccccc12)N1C2CCC(C2)C1Cc1ccccc1 | 10.1016/S0960-894X(96)00570-7 | |||
44307137 | 108888 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 4 | 0 | 4 | 5.1 | COC(=O)C(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL302315 | 108888 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 4 | 0 | 4 | 5.1 | COC(=O)C(=O)N1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
24783930 | 128852 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccc2Cl)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596461 | 128852 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccccc2Cl)c1 | 10.1016/j.bmcl.2015.04.098 | |||
10030004 | 118122 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 532 | 5 | 0 | 3 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL326889 | 118122 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 532 | 5 | 0 | 3 | 6.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Cc1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
15391369 | 109605 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 518 | 6 | 2 | 2 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(C=Cc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL305509 | 109605 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 518 | 6 | 2 | 2 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(C=Cc3ccccc32)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
44328389 | 114014 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 1 | 2 | 5.6 | c1ccc(CNC2C3CC4CCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
CHEMBL316842 | 114014 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 1 | 2 | 5.6 | c1ccc(CNC2C3CC4CCC(C3)N4[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00044a002 | |||
4189 | 213701 | 96 | None | -27 | 34 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
CHEMBL1559 | 213701 | 96 | None | -27 | 34 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
CHEMBL91 | 213701 | 96 | None | -27 | 34 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
10405461 | 67113 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 3.9 | Cc1cc(C)cc(CN2C(=O)OC(Cc3c[nH]c4ccccc34)C2=O)c1 | 10.1021/jm00006a011 | |||
CHEMBL174464 | 67113 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 3.9 | Cc1cc(C)cc(CN2C(=O)OC(Cc3c[nH]c4ccccc34)C2=O)c1 | 10.1021/jm00006a011 | |||
2090 | 9543 | 25 | None | - | 4 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
5311312 | 9543 | 25 | None | - | 4 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
CHEMBL437797 | 9543 | 25 | None | - | 4 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)81197-5 | |||||
44384987 | 68128 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1cc(OC)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL176769 | 68128 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 9 | 1 | 5 | 5.7 | COc1cc(OC)cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/0960-894X(96)00148-5 | |||
44289169 | 108265 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL297883 | 108265 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@@H](NCc3ccnc4ccccc34)C[C@@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
54585204 | 67937 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 4 | 1 | 4 | 5.7 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nncn12 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765505 | 67937 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 4 | 1 | 4 | 5.7 | Cc1c(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccccc2)cc2nncn12 | 10.1016/j.bmc.2011.02.031 | |||
10031310 | 11482 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 589 | 6 | 1 | 3 | 6.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(I)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL103510 | 11482 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 589 | 6 | 1 | 3 | 6.5 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(I)cc2)c1 | 10.1016/S0960-894X(96)00563-X | |||
10339539 | 116545 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.3 | CC(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(N)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL323128 | 116545 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.3 | CC(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(N)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
44276788 | 103271 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 550 | 8 | 1 | 3 | 7.3 | O=C(C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)NCc1ccncc1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL26251 | 103271 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 550 | 8 | 1 | 3 | 7.3 | O=C(C[C@H]1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1)NCc1ccncc1 | 10.1016/0960-894X(95)00220-N | |||
44319329 | 212749 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 389 | 4 | 1 | 2 | 5.3 | FC(F)(F)c1cc(CO[C@H]2CCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
CHEMBL84588 | 212749 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 389 | 4 | 1 | 2 | 5.3 | FC(F)(F)c1cc(CO[C@H]2CCN[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80280-8 | |||
44306045 | 107443 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL292256 | 107443 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
9871754 | 12181 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
CHEMBL107172 | 12181 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 533 | 4 | 0 | 4 | 6.2 | Cc1ccc(-c2c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c3ncccc23)cc1 | 10.1021/jm00016a014 | |||
21994328 | 37982 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL140086 | 37982 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 571 | 8 | 1 | 4 | 6.1 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
24784190 | 128863 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 469 | 6 | 1 | 4 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc3c(c2)OCO3)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596472 | 128863 | 0 | None | - | 0 | Mongolian jird | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 469 | 6 | 1 | 4 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2ccc3c(c2)OCO3)c1 | 10.1016/j.bmcl.2015.04.098 | |||
9855000 | 27393 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL130834 | 27393 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.8 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
44328400 | 114888 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 442 | 6 | 1 | 2 | 6.3 | Clc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL319559 | 114888 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 442 | 6 | 1 | 2 | 6.3 | Clc1ccccc1CNC1C2CC3CCC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
44415435 | 86916 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.3 | NC(=O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL213359 | 86916 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.3 | NC(=O)[C@@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44415469 | 174209 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | CN[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL429715 | 174209 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.8 | CN[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
11546759 | 95008 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347855 | 95008 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 5 | 0 | 2 | 6.3 | CN1CCC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1 | 10.1016/j.bmc.2013.02.010 | |||
21994352 | 126059 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 605 | 8 | 1 | 4 | 5.9 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C2Cc3ccccc3C2)CC1 | 10.1021/jm000986n | |||
CHEMBL343797 | 126059 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 605 | 8 | 1 | 4 | 5.9 | COc1ccccc1C(CNC(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C2Cc3ccccc3C2)CC1 | 10.1021/jm000986n | |||
10626865 | 64297 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 569 | 11 | 2 | 5 | 4.8 | CSc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL166178 | 64297 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 569 | 11 | 2 | 5 | 4.8 | CSc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
44328424 | 114085 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 454 | 7 | 1 | 4 | 5.2 | COc1ccccc1CNC1C2CC3CCOC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
CHEMBL317297 | 114085 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 454 | 7 | 1 | 4 | 5.2 | COc1ccccc1CNC1C2CC3CCOC(C2)N3[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00044a002 | |||
46227360 | 209361 | 0 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611924 | 209361 | 0 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
10839068 | 125502 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 499 | 7 | 0 | 5 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(Cc3ncon3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
CHEMBL341745 | 125502 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 499 | 7 | 0 | 5 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCN(Cc3ncon3)CC2)cc(C(F)(F)F)c1 | 10.1021/jm980376b | |||
24993312 | 186132 | 11 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 475 | 4 | 1 | 2 | 6.7 | C[C@@H](O[C@H]1CC[C@@H]2CNC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL473680 | 186132 | 11 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 475 | 4 | 1 | 2 | 6.7 | C[C@@H](O[C@H]1CC[C@@H]2CNC[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
10436850 | 86421 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 524 | 8 | 3 | 4 | 3.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL2115107 | 86421 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 524 | 8 | 3 | 4 | 3.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
11546190 | 112577 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@H]1CC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126960 | 112577 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.7 | N[C@H]1CC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
19098236 | 40807 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 525 | 6 | 0 | 2 | 8.1 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)C2CCCCC2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
CHEMBL142477 | 40807 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 525 | 6 | 0 | 2 | 8.1 | FC(F)(F)c1cc(COC2C3CCN(CC3)C2C(c2ccccc2)C2CCCCC2)cc(C(F)(F)F)c1 | 10.1021/jm00024a007 | |||
44319082 | 174806 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 752 | 13 | 1 | 8 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)NCCN4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL432183 | 174806 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 752 | 13 | 1 | 8 | 5.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)NCCN4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
18669085 | 90151 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 529 | 7 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(-c4ccccc4)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21939 | 90151 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 529 | 7 | 1 | 3 | 7.1 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(-c4ccccc4)cc3)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
44306693 | 109125 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 568 | 9 | 2 | 6 | 3.1 | COc1ccc(C[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)c2cn(C)c3ccccc23)C(=O)N(C)Cc2ccccc2)cc1 | 10.1021/jm00039a022 | |||
CHEMBL303750 | 109125 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 568 | 9 | 2 | 6 | 3.1 | COc1ccc(C[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)c2cn(C)c3ccccc23)C(=O)N(C)Cc2ccccc2)cc1 | 10.1021/jm00039a022 | |||
44358476 | 37136 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 6.1 | COc1cccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1OC | 10.1021/jm000986n | |||
CHEMBL139190 | 37136 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 6.1 | COc1cccc(C(CNC(=O)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCC(N3CCCCC3)CC2)c1OC | 10.1021/jm000986n | |||
44297629 | 197289 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cccc(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL51794 | 197289 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 567 | 9 | 1 | 5 | 4.4 | CS(=O)(=O)N1CC2(CCN(C(=O)[C@H](COCc3cccc(Cl)c3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
46884515 | 14597 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 553 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cn[nH]c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089532 | 14597 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 553 | 5 | 1 | 3 | 6.5 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cn[nH]c3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44456866 | 164749 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@@H]1[C@H](CO)N(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
CHEMBL408484 | 164749 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 533 | 5 | 1 | 4 | 6.6 | C[C@@H](O[C@@H]1[C@H](CO)N(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2007.11.081 | |||
24993955 | 191084 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 517 | 4 | 0 | 2 | 7.0 | CC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
CHEMBL484134 | 191084 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 517 | 4 | 0 | 2 | 7.0 | CC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
CHEMBL276294 | 217607 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(C)(C)S(C)(=O)=O)C(N)=O | 10.1021/jm00037a009 | |||||
44415447 | 148330 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL384796 | 148330 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 4 | 1 | 2 | 5.5 | N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44338640 | 174868 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 482 | 7 | 1 | 4 | 4.4 | COc1c(Br)cc(Br)cc1COCC(c1ccccc1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
CHEMBL432627 | 174868 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 482 | 7 | 1 | 4 | 4.4 | COc1c(Br)cc(Br)cc1COCC(c1ccccc1)N1CCNCC1 | 10.1016/s0960-894x(02)00563-2 | |||
44321099 | 213004 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 426 | 7 | 0 | 3 | 5.4 | COc1ccccc1CN(C)[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL86659 | 213004 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 426 | 7 | 0 | 3 | 5.4 | COc1ccccc1CN(C)[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
44368159 | 54968 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 8 | 1 | 5 | 4.6 | CN(Cc1nn[nH]n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL155218 | 54968 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 8 | 1 | 5 | 4.6 | CN(Cc1nn[nH]n1)[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
44346420 | 21077 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
CHEMBL119990 | 21077 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 473 | 5 | 0 | 3 | 4.8 | COc1ccccc1[C@H](C)C(=O)N1CC2[C@@H](C1)C(c1ccccc1)(c1ccccc1)CC[S+]2[O-] | 10.1016/S0960-894X(01)80177-3 | |||
44288758 | 107888 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cnc4ccccc4c3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL295122 | 107888 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 5.9 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3cnc4ccccc4c3)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
24785191 | 128849 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 6 | 1 | 4 | 5.7 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2nccs2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596458 | 128849 | 0 | None | - | 0 | Mongolian jird | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 6 | 1 | 4 | 5.7 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-c2nccs2)c1 | 10.1016/j.bmcl.2015.04.098 | |||
44294423 | 18811 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 0 | 5 | 5.0 | CCn1c(/C=C/C=C2\Sc3ccccc3N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
53817703 | 18811 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 0 | 5 | 5.0 | CCn1c(/C=C/C=C2\Sc3ccccc3N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183414 | 18811 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 0 | 5 | 5.0 | CCn1c(/C=C/C=C2\Sc3ccccc3N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL295686 | 18811 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 0 | 5 | 5.0 | CCn1c(/C=C/C=C2\Sc3ccccc3N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
15037919 | 126405 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 6 | 1 | 2 | 5.4 | Cc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL346633 | 126405 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 6 | 1 | 2 | 5.4 | Cc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
71541376 | 94205 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 382 | 5 | 0 | 3 | 4.4 | CN1CCC(COCc2cc(C(F)(F)F)ccn2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333630 | 94205 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 382 | 5 | 0 | 3 | 4.4 | CN1CCC(COCc2cc(C(F)(F)F)ccn2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
24785445 | 128842 | 0 | None | - | 0 | Mongolian jird | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 6 | 1 | 6 | 4.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-n2nnnc2C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596451 | 128842 | 0 | None | - | 0 | Mongolian jird | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 6 | 1 | 6 | 4.5 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCNCC2)cc(-n2nnnc2C(F)(F)F)c1 | 10.1016/j.bmcl.2015.04.098 | |||
10668476 | 106224 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 7 | 1 | 2 | 5.1 | c1ccc(CCN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
CHEMBL282996 | 106224 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 7 | 1 | 2 | 5.1 | c1ccc(CCN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80349-2 | |||
9957036 | 170937 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 6 | 1 | 3 | 6.4 | O=C(c1ccc2ccccc2c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL42103 | 170937 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 6 | 1 | 3 | 6.4 | O=C(c1ccc2ccccc2c1)N1CC[C@H](NCc2ccnc3ccccc23)C[C@H]1Cc1ccccc1 | 10.1016/0960-894X(96)00287-9 | |||
10668476 | 106224 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 7 | 1 | 2 | 5.1 | c1ccc(CCN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL282996 | 106224 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 396 | 7 | 1 | 2 | 5.1 | c1ccc(CCN[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
44380709 | 127172 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 5 | 1 | 3 | 3.6 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL353416 | 127172 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 5 | 1 | 3 | 3.6 | COc1ccccc1CN[C@@H]1C2CCN(CC2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80859-3 | |||
44297359 | 199126 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1cccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)c1 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL52070 | 199126 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 563 | 10 | 1 | 6 | 3.7 | COc1cccc(CNC(COCc2ccccc2)C(=O)N2CCC3(CC2)CN(S(C)(=O)=O)c2ccccc23)c1 | 10.1016/s0960-894x(98)00320-5 | |||
44345156 | 120884 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2/CCC(NC(=O)c3ccnc4ccccc34)CC2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
CHEMBL332759 | 120884 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 478 | 5 | 1 | 2 | 7.4 | Cc1cc(C)cc(/C(F)=C2/CCC(NC(=O)c3ccnc4ccccc34)CC2Cc2ccccc2)c1 | 10.1016/S0960-894X(96)00624-5 | |||
10674743 | 116995 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL323762 | 116995 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
100951644 | 176413 | 16 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 411 | 7 | 2 | 9 | 2.3 | CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(c3cccnn3)C2)s1)c1ccccc1 | 10.1021/acs.jmedchem.9b00260 | |||
CHEMBL4437106 | 176413 | 16 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 411 | 7 | 2 | 9 | 2.3 | CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(c3cccnn3)C2)s1)c1ccccc1 | 10.1021/acs.jmedchem.9b00260 | |||
24889283 | 15203 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 597 | 6 | 0 | 5 | 7.3 | CC(C)c1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1093595 | 15203 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 597 | 6 | 0 | 5 | 7.3 | CC(C)c1noc(C2=CC(=O)N3C[C@H](O[C@H](C)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)[C@@H](c4ccc(F)cc4)C3C2)n1 | 10.1016/j.bmcl.2010.01.120 | |||
44289218 | 170488 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 481 | 5 | 2 | 2 | 6.0 | O=C(Nc1ccccc1)N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL42050 | 170488 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 481 | 5 | 2 | 2 | 6.0 | O=C(Nc1ccccc1)N[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)[C@H](Cc2ccccc2)C1 | 10.1016/0960-894X(96)00287-9 | |||
44233184 | 201547 | 0 | None | -12 | 4 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL538131 | 201547 | 0 | None | -12 | 4 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
15037920 | 52503 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 430 | 7 | 1 | 2 | 5.8 | Clc1ccccc1CCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL153042 | 52503 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 430 | 7 | 1 | 2 | 5.8 | Clc1ccccc1CCN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44363017 | 44077 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 409 | 4 | 0 | 5 | 5.7 | CCN1/C(=C/C=C/c2nc3nc4ccccc4nc3n2CC)C(C)(C)c2ccccc21 | 10.1021/jm00024a007 | |||
CHEMBL145407 | 44077 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 409 | 4 | 0 | 5 | 5.7 | CCN1/C(=C/C=C/c2nc3nc4ccccc4nc3n2CC)C(C)(C)c2ccccc21 | 10.1021/jm00024a007 | |||
44358982 | 37438 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 10 | 4 | 5 | 4.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(NS(C)(=O)=O)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
CHEMBL139464 | 37438 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 10 | 4 | 5 | 4.6 | C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1cccc(NS(C)(=O)=O)c1)c1ccccc1 | 10.1021/jm00022a010 | |||
42639649 | 177524 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 553 | 5 | 0 | 4 | 7.4 | C[C@@H](O[C@H]1CC[C@@H]2CN(c3cnccn3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
CHEMBL445239 | 177524 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 553 | 5 | 0 | 4 | 7.4 | C[C@@H](O[C@H]1CC[C@@H]2CN(c3cnccn3)C[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm8016514 | |||
44370352 | 58268 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 683 | 18 | 1 | 5 | 7.5 | CCCCCN(CCCCC)C(=O)[C@@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL158255 | 58268 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 683 | 18 | 1 | 5 | 7.5 | CCCCCN(CCCCC)C(=O)[C@@H]1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/0960-894X(95)00080-D | |||
44212282 | 68061 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1ccccc1C(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
CHEMBL176682 | 68061 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 5.7 | COc1ccccc1C(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/0960-894X(96)00148-5 | |||
19960248 | 176863 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm980376b | |||
CHEMBL444339 | 176863 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1ccc(COCC2(c3ccccc3)CCNCC2)cc1 | 10.1021/jm980376b | |||
10452352 | 135303 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 380 | 6 | 1 | 5 | 3.3 | COc1cc(CN2C(=O)OC(Cc3c[nH]c4ccccc34)C2=O)cc(OC)c1 | 10.1021/jm00006a011 | |||
CHEMBL366753 | 135303 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 380 | 6 | 1 | 5 | 3.3 | COc1cc(CN2C(=O)OC(Cc3c[nH]c4ccccc34)C2=O)cc(OC)c1 | 10.1021/jm00006a011 | |||
76336391 | 112582 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 471 | 7 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(NC3CC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126965 | 112582 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 471 | 7 | 1 | 2 | 6.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(NC3CC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
71541372 | 94223 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 384 | 5 | 1 | 3 | 4.6 | FC(F)(F)c1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333648 | 94223 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 384 | 5 | 1 | 3 | 4.6 | FC(F)(F)c1cc(Cl)cc(COCC2(c3ccccc3)CCNCC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
11634999 | 94992 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 521 | 7 | 0 | 2 | 7.9 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCN(Cc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2347691 | 94992 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 521 | 7 | 0 | 2 | 7.9 | FC(F)(F)c1cc(COC[C@@]2(c3ccccc3)CCCN(Cc3ccccc3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.02.010 | |||
131871 | 126306 | 6 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 450 | 6 | 1 | 2 | 6.1 | FC(F)(F)c1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL345711 | 126306 | 6 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 450 | 6 | 1 | 2 | 6.1 | FC(F)(F)c1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44359010 | 36772 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 512 | 9 | 4 | 4 | 5.2 | CC(=O)Nc1cccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c1 | 10.1021/jm00022a010 | |||
CHEMBL138883 | 36772 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 512 | 9 | 4 | 4 | 5.2 | CC(=O)Nc1cccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)c1 | 10.1021/jm00022a010 | |||
23294208 | 103923 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 590 | 8 | 1 | 4 | 6.8 | O=C1CCC(CCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL26790 | 103923 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 590 | 8 | 1 | 4 | 6.8 | O=C1CCC(CCCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1016/s0960-894x(98)00215-7 | |||
44299310 | 103510 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 351 | 7 | 1 | 2 | 5.0 | NC(COCc1cccc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL264376 | 103510 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 351 | 7 | 1 | 2 | 5.0 | NC(COCc1cccc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL436706 | 220465 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(C)C)C(N)=O | 10.1016/S0960-894X(01)80229-8 | |||||
44346497 | 21315 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 351 | 7 | 1 | 2 | 5.0 | N[C@H](COCc1cccc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
CHEMBL120286 | 21315 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 351 | 7 | 1 | 2 | 5.0 | N[C@H](COCc1cccc(Cl)c1)C(c1ccccc1)c1ccccc1 | 10.1021/jm9700171 | |||
10407632 | 108601 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 383 | 6 | 0 | 2 | 5.5 | c1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
CHEMBL30029 | 108601 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 383 | 6 | 0 | 2 | 5.5 | c1ccc(CO[C@H]2C3CCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm9700171 | |||
10736544 | 109532 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 349 | 6 | 2 | 2 | 2.9 | CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL305094 | 109532 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 349 | 6 | 2 | 2 | 2.9 | CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
10520658 | 105423 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL277260 | 105423 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
10025594 | 97665 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 428 | 8 | 2 | 4 | 4.3 | COc1cccc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
CHEMBL23928 | 97665 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 428 | 8 | 2 | 4 | 4.3 | COc1cccc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccc2)c1 | 10.1021/jm00035a006 | |||
24799365 | 94194 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 425 | 7 | 1 | 4 | 4.9 | CCNc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333619 | 94194 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 425 | 7 | 1 | 4 | 4.9 | CCNc1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
9852376 | 105878 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 639 | 8 | 0 | 4 | 6.6 | CS(=O)(=O)N1CC2(CCN(CCCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL280789 | 105878 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 639 | 8 | 0 | 4 | 6.6 | CS(=O)(=O)N1CC2(CCN(CCCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00215-7 | |||
44385121 | 67942 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 350 | 7 | 2 | 2 | 4.0 | CC(=O)N[C@H](COCc1cc(C)cc(C)c1)Cc1c[nH]c2ccccc12 | 10.1021/jm00006a012 | |||
CHEMBL176557 | 67942 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 350 | 7 | 2 | 2 | 4.0 | CC(=O)N[C@H](COCc1cc(C)cc(C)c1)Cc1c[nH]c2ccccc12 | 10.1021/jm00006a012 | |||
44299753 | 202421 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 443 | 7 | 1 | 2 | 5.0 | NC(COCc1cccc(I)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL55635 | 202421 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 443 | 7 | 1 | 2 | 5.0 | NC(COCc1cccc(I)c1)C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)80531-X | |||
44287861 | 168518 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 472 | 5 | 1 | 4 | 4.4 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)[C@@H](O)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL41375 | 168518 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 472 | 5 | 1 | 4 | 4.4 | CN(C)c1ccccc1CC(=O)N1C[C@@H]2[C@H](C1)[C@@H](O)CSC2(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL415600 | 219973 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1021/jm00037a009 | |||||
56661421 | 73222 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817831 | 73222 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852028 | 73222 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 421 | 6 | 0 | 3 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)cc1 | 10.1016/j.bmc.2011.07.014 | |||
44312000 | 211458 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 8 | 3 | 3 | 4.6 | CC(=O)NC1(c2ccccc2)CCN(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N(C)Cc2ccccc2)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL73839 | 211458 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 8 | 3 | 3 | 4.6 | CC(=O)NC1(c2ccccc2)CCN(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N(C)Cc2ccccc2)CC1 | 10.1016/s0960-894x(98)00395-3 | |||
14999557 | 109402 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL304246 | 109402 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
68870105 | 131565 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642164 | 131565 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
16755281 | 183578 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 439 | 6 | 1 | 7 | 3.9 | COc1cc(CNC(=O)c2c(-c3ccccc3)c3ccccc3n3nnnc23)cc(OC)c1 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL460684 | 183578 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 439 | 6 | 1 | 7 | 3.9 | COc1cc(CNC(=O)c2c(-c3ccccc3)c3ccccc3n3nnnc23)cc(OC)c1 | 10.1016/j.bmc.2008.05.067 | |||
44297698 | 201769 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cc(Cl)cc(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL54717 | 201769 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3cc(Cl)cc(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
68932311 | 131571 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 4.3 | CN(C(=O)c1ccc(Cl)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
CHEMBL3642170 | 131571 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 4.3 | CN(C(=O)c1ccc(Cl)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
44322724 | 213076 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 6 | 1 | 3 | 5.2 | Cc1cccc(CN(C(=O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
CHEMBL87066 | 213076 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 6 | 1 | 3 | 5.2 | Cc1cccc(CN(C(=O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2CCNCC2)c1 | 10.1016/s0960-894x(01)00727-2 | |||
24800577 | 94203 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 448 | 6 | 1 | 5 | 3.7 | CN1CCN(c2cc(C(F)(F)F)cc(COCC3(c4ccccc4)CCNCC3)n2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333628 | 94203 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 448 | 6 | 1 | 5 | 3.7 | CN1CCN(c2cc(C(F)(F)F)cc(COCC3(c4ccccc4)CCNCC3)n2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
15755302 | 109096 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 614 | 16 | 4 | 8 | 2.9 | CSCC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL303543 | 109096 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 614 | 16 | 4 | 8 | 2.9 | CSCC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
44458869 | 18758 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 420 | 2 | 0 | 2 | 6.2 | CCn1c2[n+](c3cc4ccccc4cc31)CCC2=C/C=C1\N(C)c2ccccc2C1(C)C | 10.1021/jm00085a015 | |||
CHEMBL1183106 | 18758 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 420 | 2 | 0 | 2 | 6.2 | CCn1c2[n+](c3cc4ccccc4cc31)CCC2=C/C=C1\N(C)c2ccccc2C1(C)C | 10.1021/jm00085a015 | |||
CHEMBL280339 | 18758 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 420 | 2 | 0 | 2 | 6.2 | CCn1c2[n+](c3cc4ccccc4cc31)CCC2=C/C=C1\N(C)c2ccccc2C1(C)C | 10.1021/jm00085a015 | |||
44375286 | 126888 | 0 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL351059 | 126888 | 0 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
9827668 | 119049 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 420 | 8 | 2 | 3 | 4.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
CHEMBL329105 | 119049 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 420 | 8 | 2 | 3 | 4.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/s0960-894x(97)10163-9 | |||
11647974 | 112588 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 6 | 0 | 2 | 6.3 | CN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126970 | 112588 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 6 | 0 | 2 | 6.3 | CN(C)C1CCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2014.01.036 | |||
9938657 | 66996 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
CHEMBL174038 | 66996 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 565 | 8 | 2 | 3 | 5.9 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CCN(CC1)CC2 | 10.1021/jm00006a012 | |||
9827668 | 119049 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 420 | 8 | 2 | 3 | 4.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL329105 | 119049 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 420 | 8 | 2 | 3 | 4.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
44458598 | 105624 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 489 | 6 | 1 | 4 | 5.7 | CC(=O)N[C@@H](Cc1csc2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00035a006 | |||
CHEMBL278849 | 105624 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 489 | 6 | 1 | 4 | 5.7 | CC(=O)N[C@@H](Cc1csc2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm00035a006 | |||
107686 | 10152 | 41 | None | 15 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
3522 | 10152 | 41 | None | 15 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL131171 | 10152 | 41 | None | 15 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/0960-894X(95)00277-Z | |||
44274331 | 89235 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1cccc(-c2[nH]c3ccc(C)cc3c2CCC(=O)N2CCN(c3ccccc3OC)CC2)c1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21759 | 89235 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1cccc(-c2[nH]c3ccc(C)cc3c2CCC(=O)N2CCN(c3ccccc3OC)CC2)c1 | 10.1016/s0960-894x(01)00183-4 | |||
44433799 | 95443 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 5.8 | Cc1cnc(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
CHEMBL235882 | 95443 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 582 | 5 | 0 | 4 | 5.8 | Cc1cnc(C(=O)N2C[C@H](c3ccc(F)cc3C)[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cn1 | 10.1016/j.bmcl.2007.08.028 | |||
44306000 | 107660 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 494 | 8 | 2 | 3 | 3.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL293675 | 107660 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 494 | 8 | 2 | 3 | 3.8 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1CCN1C(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44370925 | 126391 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 654 | 17 | 1 | 4 | 7.2 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
CHEMBL346485 | 126391 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 654 | 17 | 1 | 4 | 7.2 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)[C@H](C(=O)NCCCN(CC)CC)C1 | 10.1016/0960-894X(95)00080-D | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm00006a012 | |||
58993629 | 128881 | 0 | None | - | 0 | Mongolian jird | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 451 | 6 | 1 | 4 | 5.5 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)nc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596490 | 128881 | 0 | None | - | 0 | Mongolian jird | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 451 | 6 | 1 | 4 | 5.5 | N#Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)nc1 | 10.1016/j.bmcl.2015.04.098 | |||
24888772 | 14788 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccncc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090752 | 14788 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccncc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44319307 | 113324 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL314119 | 113324 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 640 | 10 | 1 | 7 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4cccnc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44415399 | 86829 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 487 | 6 | 0 | 3 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CC[C@@H](CN3CCOCC3)[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL212978 | 86829 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 487 | 6 | 0 | 3 | 6.1 | FC(F)(F)c1cc(CO[C@H]2CC[C@@H](CN3CCOCC3)[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.06.035 | |||
44415449 | 87040 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL213908 | 87040 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 7 | 2 | 3 | 4.6 | NC(=O)CN[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
44290030 | 180317 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 527 | 10 | 2 | 5 | 4.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)Cc1ccc2c(c1)OCCO2)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL45316 | 180317 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 527 | 10 | 2 | 5 | 4.3 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)Cc1ccc2c(c1)OCCO2)C(C)=O | 10.1016/s0960-894x(01)00250-5 | |||
19797439 | 43660 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 443 | 8 | 0 | 4 | 5.5 | COc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1021/jm00024a007 | |||
CHEMBL145077 | 43660 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 443 | 8 | 0 | 4 | 5.5 | COc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1021/jm00024a007 | |||
10577745 | 63918 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 514 | 11 | 1 | 5 | 3.6 | COc1ccccc1CN(CC(Cc1ccccc1)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL164563 | 63918 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 514 | 11 | 1 | 5 | 3.6 | COc1ccccc1CN(CC(Cc1ccccc1)NC(=O)CN1CCN(c2ccccc2)CC1)C(C)=O | 10.1021/jm950616c | |||
24782913 | 128868 | 0 | None | - | 0 | Mongolian jird | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596477 | 128868 | 0 | None | - | 0 | Mongolian jird | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 439 | 6 | 1 | 2 | 6.5 | Cc1ccc(-c2cc(COCC3(c4ccccc4)CCNCC3)cc(C(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2015.04.098 | |||
57402686 | 78380 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 3.8 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL1963297 | 78380 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 3.8 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL3217199 | 78380 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 3.8 | COc1ccc(OC(F)(F)F)cc1CN[C@H]1CCNC[C@H]1c1ccccc1 | 10.1016/j.bmc.2011.08.070 | |||
10053175 | 11641 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 546 | 4 | 0 | 3 | 7.1 | Cc1cc2c(-c3ccccc3)c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
CHEMBL104370 | 11641 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 546 | 4 | 0 | 3 | 7.1 | Cc1cc2c(-c3ccccc3)c(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n(C)c(=O)c2cc1C | 10.1021/jm00016a014 | |||
44319223 | 113882 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 669 | 11 | 1 | 7 | 5.7 | COc1cccc(C2(C(N)=O)CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)c1 | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL315982 | 113882 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 669 | 11 | 1 | 7 | 5.7 | COc1cccc(C2(C(N)=O)CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)c1 | 10.1016/S0960-894X(97)10013-0 | |||
10202046 | 127839 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL356912 | 127839 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 416 | 6 | 1 | 2 | 5.7 | Clc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
46884471 | 14521 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cccnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1089062 | 14521 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 5 | 0 | 3 | 7.2 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3cccnc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44352062 | 25706 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CC[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL128586 | 25706 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 573 | 3 | 0 | 4 | 7.1 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)CC[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
44319355 | 112299 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 605 | 10 | 1 | 6 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL312173 | 112299 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 605 | 10 | 1 | 6 | 5.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
71541473 | 94181 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 450 | 6 | 0 | 3 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3(C)C)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333607 | 94181 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 450 | 6 | 0 | 3 | 5.9 | CN1CCC(COCc2cc(C(F)(F)F)cc(C3CC3(C)C)n2)(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2012.11.094 | |||
107686 | 10152 | 41 | None | - | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
3522 | 10152 | 41 | None | - | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
CHEMBL131171 | 10152 | 41 | None | - | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1021/jm950616c | |||
44319308 | 113155 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 709 | 10 | 0 | 7 | 6.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL313931 | 113155 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 709 | 10 | 0 | 7 | 6.1 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)N4CCOCC4)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44274181 | 85013 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 6.7 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(OC(F)(F)F)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21062 | 85013 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 6.7 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3ccc(OC(F)(F)F)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
44358475 | 37134 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 613 | 7 | 0 | 5 | 6.2 | CN(CC(c1ccc2c(c1)OCCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
CHEMBL139189 | 37134 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 613 | 7 | 0 | 5 | 6.2 | CN(CC(c1ccc2c(c1)OCCO2)N1CCC(N2CCCCC2)CC1)C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm000986n | |||
10063954 | 105508 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm9700171 | |||
CHEMBL277918 | 105508 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm9700171 | |||
44297484 | 202782 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 533 | 9 | 1 | 5 | 3.7 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL56003 | 202782 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 533 | 9 | 1 | 5 | 3.7 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3ccccc3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
18986937 | 174936 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 369 | 5 | 1 | 2 | 5.5 | Cc1cc(C)cc(COCC(N)C2c3ccccc3C=Cc3ccccc32)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL433107 | 174936 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 369 | 5 | 1 | 2 | 5.5 | Cc1cc(C)cc(COCC(N)C2c3ccccc3C=Cc3ccccc32)c1 | 10.1016/S0960-894X(00)80063-3 | |||
68930433 | 131567 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 583 | 4 | 0 | 3 | 5.7 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C(F)(F)F)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
CHEMBL3642166 | 131567 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 583 | 4 | 0 | 3 | 5.7 | CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C(F)(F)F)cc3)[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 | nan | |||
19797417 | 44090 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL145414 | 44090 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 6 | 0 | 2 | 6.2 | Clc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
10099318 | 63961 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
CHEMBL164912 | 63961 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(C2CCCCC2)CC1)C(C)=O | 10.1021/jm950616c | |||
14986135 | 170180 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL419500 | 170180 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
44337620 | 116516 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 595 | 9 | 2 | 5 | 5.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL322976 | 116516 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 595 | 9 | 2 | 5 | 5.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1CCCN1/C(S)=N/c1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
9979913 | 115248 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 426 | 6 | 0 | 4 | 5.5 | COc1ccccc1CN(C)Cc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL319932 | 115248 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 426 | 6 | 0 | 4 | 5.5 | COc1ccccc1CN(C)Cc1c(-c2ccccc2)c2cc(C)c(C)cc2c(=O)n1C | 10.1021/jm00016a014 | |||
104974 | 10248 | 31 | None | -1202 | 7 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/s0960-894x(98)00395-3 | |||
2111 | 10248 | 31 | None | -1202 | 7 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/s0960-894x(98)00395-3 | |||
3481 | 10248 | 31 | None | -1202 | 7 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL308148 | 10248 | 31 | None | -1202 | 7 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/s0960-894x(98)00395-3 | |||
DB06660 | 10248 | 31 | None | -1202 | 7 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/s0960-894x(98)00395-3 | |||
CHEMBL334721 | 218178 | 1 | None | - | 3 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CSCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CNC(=O)C[C@H](NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 | 10.1016/S0960-894X(96)00570-7 | |||||
44358520 | 37144 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 555 | 8 | 1 | 3 | 5.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(Cc1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL139198 | 37144 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 555 | 8 | 1 | 3 | 5.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC(Cc1ccccc1)N1CCC(N2CCCCC2)CC1 | 10.1021/jm000986n | |||
44346693 | 22175 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 421 | 9 | 1 | 2 | 7.1 | Cc1cc(C)cc(COC[C@@H](Nc2ccccc2)C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
CHEMBL121480 | 22175 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 421 | 9 | 1 | 2 | 7.1 | Cc1cc(C)cc(COC[C@@H](Nc2ccccc2)C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm9700171 | |||
44366601 | 49200 | 11 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 323 | 4 | 0 | 3 | 3.5 | O=C1CCN(C(=O)OCc2ccccc2)CC1Cc1ccccc1 | 10.1016/0960-894X(94)80030-8 | |||
CHEMBL149905 | 49200 | 11 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 323 | 4 | 0 | 3 | 3.5 | O=C1CCN(C(=O)OCc2ccccc2)CC1Cc1ccccc1 | 10.1016/0960-894X(94)80030-8 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80246-2 | |||
44346200 | 21185 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(CO[C@@H]2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm9700171 | |||
CHEMBL120038 | 21185 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(CO[C@@H]2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1021/jm9700171 | |||
44299876 | 169956 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 435 | 10 | 1 | 2 | 6.8 | Cc1cc(C)cc(COCC(NCc2ccccc2)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL418114 | 169956 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 435 | 10 | 1 | 2 | 6.8 | Cc1cc(C)cc(COCC(NCc2ccccc2)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
44274392 | 84866 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1ccccc1-c1[nH]c2ccc(C)cc2c1CCC(=O)N1CCN(c2ccccc2OC)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21018 | 84866 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 483 | 7 | 1 | 4 | 5.4 | COc1ccccc1-c1[nH]c2ccc(C)cc2c1CCC(=O)N1CCN(c2ccccc2OC)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
22293476 | 86480 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 592 | 7 | 1 | 2 | 8.7 | Fc1ccc(C2CCN([C@H]3CC[C@@](CNCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115450 | 86480 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 592 | 7 | 1 | 2 | 8.7 | Fc1ccc(C2CCN([C@H]3CC[C@@](CNCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1 | 10.1016/s0960-894x(02)00249-4 | |||
44337569 | 15992 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 597 | 9 | 2 | 5 | 5.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL110558 | 15992 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 597 | 9 | 2 | 5 | 5.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
10520658 | 105423 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL277260 | 105423 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 333 | 4 | 0 | 2 | 5.0 | Cc1cc(C)cc(COC2/C(=C/c3ccccc3)N3CCC2CC3)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL2369630 | 216424 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
9851211 | 11971 | 33 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL106092 | 11971 | 33 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
44287606 | 107287 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 470 | 5 | 0 | 4 | 4.6 | CN(C)c1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL291146 | 107287 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 470 | 5 | 0 | 4 | 4.6 | CN(C)c1ccccc1CC(=O)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
10344874 | 126928 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL351387 | 126928 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 3 | 5 | 4.6 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Nc1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(01)00044-0 | |||
10907460 | 16600 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 521 | 11 | 1 | 3 | 5.8 | CCOc1ccc(CCNC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
CHEMBL113956 | 16600 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 521 | 11 | 1 | 3 | 5.8 | CCOc1ccc(CCNC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
10548166 | 41874 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1ccccc1COCC1(c2ccccc2)CCNCC1 | 10.1021/jm980376b | |||
CHEMBL143377 | 41874 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 349 | 5 | 1 | 2 | 4.5 | FC(F)(F)c1ccccc1COCC1(c2ccccc2)CCNCC1 | 10.1021/jm980376b | |||
68928720 | 131575 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 5 | 1 | 4 | 4.4 | CN(C(=O)c1ccc(Br)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
CHEMBL3642174 | 131575 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 5 | 1 | 4 | 4.4 | CN(C(=O)c1ccc(Br)cc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)CO)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 | nan | |||
10454303 | 12257 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 5.8 | Cc1cccc(NC(=O)Nc2c(-c3ccccc3)c3cc(C)c(C)cc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
CHEMBL107619 | 12257 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 5.8 | Cc1cccc(NC(=O)Nc2c(-c3ccccc3)c3cc(C)c(C)cc3c(=O)n2C)c1 | 10.1021/jm00016a014 | |||
44458353 | 106380 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
CHEMBL283979 | 106380 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 335 | 5 | 0 | 2 | 4.5 | Cc1cc(C)cc(CO[C@H]2C3CCN(CC3)[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(95)00205-8 | |||
44307090 | 107486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 461 | 6 | 1 | 3 | 5.5 | O=C(O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
CHEMBL292496 | 107486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 461 | 6 | 1 | 3 | 5.5 | O=C(O)CN1CCC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/0960-894X(95)00009-I | |||
21955298 | 86481 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2115451 | 86481 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 606 | 6 | 1 | 2 | 8.2 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1 | 10.1016/s0960-894x(02)00249-4 | |||
CHEMBL2369607 | 216419 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
10840161 | 175048 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 539 | 12 | 2 | 5 | 4.5 | CCN(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
CHEMBL433906 | 175048 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 539 | 12 | 2 | 5 | 4.5 | CCN(Cc1ccccc1OC)CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1 | 10.1021/jm950616c | |||
9832198 | 113532 | 0 | None | 100 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
CHEMBL3144351 | 113532 | 0 | None | 100 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 788 | 15 | 4 | 8 | 3.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C(=O)CCC(=O)O)c2ccccc12)NC(=O)C[C@@H]1NC(=O)[C@@H]2C3CCC(CC3)N2C1=O | 10.1021/jm00063a015 | |||
44294408 | 18022 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\C3C=CCc4cccc(c43)N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1178974 | 18022 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\C3C=CCc4cccc(c43)N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL52114 | 18022 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\C3C=CCc4cccc(c43)N2C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
44294305 | 18812 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 8 | 0 | 6 | 5.6 | CCOC(=O)CCC[n+]1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)n(CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
74972643 | 18812 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 8 | 0 | 6 | 5.6 | CCOC(=O)CCC[n+]1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)n(CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183417 | 18812 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 8 | 0 | 6 | 5.6 | CCOC(=O)CCC[n+]1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)n(CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL295781 | 18812 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 8 | 0 | 6 | 5.6 | CCOC(=O)CCC[n+]1c(/C=C/C=C2/N(C)c3ccccc3C2(C)C)n(CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
21994241 | 36540 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 469 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1ccc(Cl)cc1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
CHEMBL138695 | 36540 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 469 | 8 | 1 | 4 | 4.7 | COc1ccccc1C(CNC(=O)Cc1ccc(Cl)cc1)N1CCN(C2CCCCC2)CC1 | 10.1021/jm000986n | |||
71458099 | 86366 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
CHEMBL2114398 | 86366 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 7 | 2 | 3 | 5.4 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)cc1 | 10.1016/s0960-894x(00)00260-2 | |||
44348676 | 24721 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 441 | 1 | 1 | 4 | 5.8 | C=C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
CHEMBL126009 | 24721 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 441 | 1 | 1 | 4 | 5.8 | C=C[C@]1(O)CCC2C3CCC4Cc5nc6nc7ccccc7n6cc5C[C@]4(C)C3CC[C@@]21C | 10.1021/jm00080a025 | |||
19797445 | 126216 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL344970 | 126216 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
44383265 | 127298 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 456 | 8 | 1 | 4 | 5.5 | COc1ccc(CN[C@H]2C3CCCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c(OC)c1 | 10.1016/S0960-894X(00)80693-9 | |||
CHEMBL354542 | 127298 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 456 | 8 | 1 | 4 | 5.5 | COc1ccc(CN[C@H]2C3CCCN(CC3)[C@H]2C(c2ccccc2)c2ccccc2)c(OC)c1 | 10.1016/S0960-894X(00)80693-9 | |||
10408564 | 12755 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 4.1 | COc1ccccc1CNC(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
CHEMBL108010 | 12755 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 4.1 | COc1ccccc1CNC(=O)c1c(-c2ccccc2)c2ccccc2c(=O)n1C | 10.1021/jm00016a014 | |||
10474902 | 95460 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 3.8 | COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
CHEMBL23597 | 95460 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 380 | 6 | 2 | 4 | 3.8 | COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C)cc(C)c1 | 10.1021/jm00035a006 | |||
44299830 | 203456 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 3 | 1 | 3 | 4.9 | FC(F)(F)c1cc(C2OC2[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
CHEMBL56458 | 203456 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 3 | 1 | 3 | 4.9 | FC(F)(F)c1cc(C2OC2[C@@H]2OCCN[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80534-5 | |||
44274326 | 88327 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 457 | 6 | 1 | 3 | 5.3 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21612 | 88327 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 457 | 6 | 1 | 3 | 5.3 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
58993640 | 128840 | 0 | None | - | 0 | Mongolian jird | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 7 | 1 | 7 | 2.8 | COc1ccc(-n2nnnc2C)cc1COCC1(c2ccccc2)CCNCC1 | 10.1016/j.bmcl.2015.04.098 | |||
CHEMBL3596449 | 128840 | 0 | None | - | 0 | Mongolian jird | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 7 | 1 | 7 | 2.8 | COc1ccc(-n2nnnc2C)cc1COCC1(c2ccccc2)CCNCC1 | 10.1016/j.bmcl.2015.04.098 | |||
2090 | 9543 | 25 | None | - | 4 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
5311312 | 9543 | 25 | None | - | 4 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
CHEMBL437797 | 9543 | 25 | None | - | 4 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(01)80229-8 | |||||
44297523 | 107469 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 651 | 9 | 1 | 6 | 4.2 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL292404 | 107469 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 651 | 9 | 1 | 6 | 4.2 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44288770 | 166591 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 557 | 7 | 1 | 3 | 7.6 | FC(F)(F)c1cc(CN2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL41057 | 166591 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 557 | 7 | 1 | 3 | 7.6 | FC(F)(F)c1cc(CN2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(96)00287-9 | |||
10408912 | 103184 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 404 | 4 | 0 | 2 | 6.2 | FC(F)(F)c1cc(CO[C@H]2CCCO[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
CHEMBL26193 | 103184 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 404 | 4 | 0 | 2 | 6.2 | FC(F)(F)c1cc(CO[C@H]2CCCO[C@H]2c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/0960-894X(95)00220-N | |||
44274534 | 105735 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3Br)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL279726 | 105735 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 6.2 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccccc3Br)[nH]c3ccc(C)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
46884431 | 14827 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 563 | 5 | 0 | 2 | 7.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccccc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1091043 | 14827 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 563 | 5 | 0 | 2 | 7.8 | C[C@@H](O[C@H]1CN2C(=O)C=C(c3ccccc3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
54581461 | 68037 | 0 | None | -2089 | 4 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
CHEMBL1766207 | 68037 | 0 | None | -2089 | 4 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
44276792 | 105907 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 604 | 8 | 1 | 4 | 6.5 | O=C1CCC(CCCN2CCC3(CC2)CN(c2ccccc2)NC3=O)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1016/s0960-894x(98)00215-7 | |||
CHEMBL281019 | 105907 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 604 | 8 | 1 | 4 | 6.5 | O=C1CCC(CCCN2CCC3(CC2)CN(c2ccccc2)NC3=O)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1016/s0960-894x(98)00215-7 | |||
44297685 | 107855 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3c(Cl)cccc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
CHEMBL294843 | 107855 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 601 | 9 | 1 | 5 | 5.0 | CS(=O)(=O)N1CC2(CCN(C(=O)C(COCc3ccccc3)NCc3c(Cl)cccc3Cl)CC2)c2ccccc21 | 10.1016/s0960-894x(98)00320-5 | |||
44334072 | 11867 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 7.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
CHEMBL105560 | 11867 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 531 | 6 | 1 | 3 | 7.2 | Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(96)00563-X | |||
11295303 | 101837 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CN)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
CHEMBL25521 | 101837 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 517 | 5 | 1 | 3 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(CN)nc2ccccc2c1-c1ccccc1 | 10.1021/jm034219a | |||
44305557 | 209592 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.3 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCC3)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1021/jm058225d | |||
CHEMBL62341 | 209592 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.3 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCC3)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1021/jm058225d | |||
44287803 | 106986 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 456 | 5 | 1 | 4 | 5.0 | COc1ccccc1CC(=N)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
CHEMBL288371 | 106986 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 456 | 5 | 1 | 4 | 5.0 | COc1ccccc1CC(=N)N1CC2C(=O)CSC(c3ccccc3)(c3ccccc3)C2C1 | 10.1016/0960-894X(95)00277-Z | |||
44410194 | 83658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 511 | 5 | 1 | 6 | 5.0 | Cn1nnnc1C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
CHEMBL206983 | 83658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 511 | 5 | 1 | 6 | 5.0 | Cn1nnnc1C1CC2(c3ccccc3)NC1CCC2OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.12.069 | |||
16755253 | 192968 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 528 | 4 | 0 | 4 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cnnc12 | 10.1016/j.bmc.2008.05.067 | |||
CHEMBL487276 | 192968 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 528 | 4 | 0 | 4 | 6.9 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1c(-c2ccccc2)c2ccccc2n2cnnc12 | 10.1016/j.bmc.2008.05.067 | |||
118722858 | 122972 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 399 | 7 | 1 | 5 | 4.9 | O=C(N[C@@H](Cc1ccccc1)c1nnc(-c2ccccc2)o1)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL3358424 | 122972 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 399 | 7 | 1 | 5 | 4.9 | O=C(N[C@@H](Cc1ccccc1)c1nnc(-c2ccccc2)o1)OCc1ccccc1 | 10.1021/ml5002954 | |||
44306757 | 107730 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 511 | 9 | 2 | 4 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)/C=C/c1ccccc1 | 10.1021/jm00039a022 | |||
CHEMBL294114 | 107730 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 511 | 9 | 2 | 4 | 3.0 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C1C[C@@H](O)CN1C(=O)/C=C/c1ccccc1 | 10.1021/jm00039a022 | |||
44306092 | 210203 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 525 | 11 | 4 | 4 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL65703 | 210203 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 525 | 11 | 4 | 4 | 2.5 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00039a022 | |||
44324793 | 213781 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 670 | 17 | 2 | 5 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNCc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL91438 | 213781 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 670 | 17 | 2 | 5 | 6.6 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCNCc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44324775 | 214093 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 684 | 17 | 1 | 5 | 7.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL93401 | 214093 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 684 | 17 | 1 | 5 | 7.0 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)NCCN(C)Cc2ccccc2OC)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44289197 | 107931 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 5 | 2 | 4 | 6.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1)c1cc(O)nc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL295425 | 107931 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 5 | 2 | 4 | 6.6 | O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2ccccc2)C1)c1cc(O)nc2ccccc12 | 10.1016/0960-894X(96)00287-9 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
19797460 | 127790 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.8 | Clc1cc(Cl)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
CHEMBL356518 | 127790 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 451 | 6 | 0 | 2 | 6.8 | Clc1cc(Cl)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00024a007 | |||
44305557 | 209592 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.3 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCC3)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
CHEMBL62341 | 209592 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.3 | COc1cc(C(=O)Nc2cc(C(=O)NC3CCCCC3)ccc2-c2ccc(Cl)cc2)cc(OC)c1OC | 10.1016/s0960-894x(02)00382-7 | |||
10063954 | 105508 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
CHEMBL277918 | 105508 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 309 | 5 | 1 | 2 | 4.1 | Cc1cc(C)cc(COCC2(c3ccccc3)CCNCC2)c1 | 10.1021/jm980376b | |||
71541472 | 94180 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 436 | 6 | 0 | 3 | 5.5 | CC1CC1c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
CHEMBL2333606 | 94180 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 436 | 6 | 0 | 3 | 5.5 | CC1CC1c1cc(C(F)(F)F)cc(COCC2(c3ccc(F)cc3)CCN(C)CC2)n1 | 10.1016/j.bmcl.2012.11.094 | |||
44346536 | 23077 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1021/jm9700171 | |||
CHEMBL122580 | 23077 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1021/jm9700171 | |||
44306106 | 109584 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cccc(F)c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
CHEMBL305368 | 109584 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 556 | 8 | 2 | 5 | 3.3 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1cccc(F)c1)NC(=O)C1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12 | 10.1021/jm00039a022 | |||
10531588 | 127133 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 597 | 13 | 3 | 6 | 3.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CC(=O)O | 10.1021/jm950616c | |||
CHEMBL353116 | 127133 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 597 | 13 | 3 | 6 | 3.5 | COc1ccccc1CN(CC(Cc1c[nH]c2ccccc12)NC(=O)CN1CCN(c2ccccc2)CC1)C(=O)CC(=O)O | 10.1021/jm950616c | |||
44346536 | 23077 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
CHEMBL122580 | 23077 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 4.3 | COc1ccc(CN[C@H]2C3CCN(CC3)[C@H]2c2cccc(Cl)c2)c(OC)c1 | 10.1016/S0960-894X(01)80859-3 | |||
19049319 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL417784 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(00)80063-3 | |||
19049319 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL417784 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
19797439 | 43660 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 443 | 8 | 0 | 4 | 5.5 | COc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1021/jm00024a007 | |||
CHEMBL145077 | 43660 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 443 | 8 | 0 | 4 | 5.5 | COc1cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc(OC)c1 | 10.1021/jm00024a007 | |||
19049319 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm0311487 | |||
CHEMBL417784 | 169913 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 345 | 7 | 1 | 2 | 5.0 | Cc1cc(C)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm0311487 | |||
56658036 | 73237 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c(OC)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817885 | 73237 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c(OC)c1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852128 | 73237 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 451 | 7 | 0 | 4 | 5.2 | COc1ccc(CN2CCC(=O)C(C(c3ccc(F)cc3)c3ccc(F)cc3)C2)c(OC)c1 | 10.1016/j.bmc.2011.07.014 | |||
23653789 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
9280 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
CHEMBL447955 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
DB12973 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm400751p | |||
23653789 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
9280 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
CHEMBL447955 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
DB12973 | 10359 | 24 | None | - | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 10.1021/jm8016514 | |||
10698085 | 26177 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.7 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)C[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
CHEMBL129354 | 26177 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 3 | 0 | 4 | 6.7 | Cc1ccc(-c2c3n(c(=O)c4ncccc24)C[C@H](C)CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)cc1 | 10.1021/jm990220r | |||
24888942 | 14718 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 7.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
CHEMBL1090437 | 14718 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 569 | 5 | 0 | 3 | 7.0 | C[C@@H](O[C@H]1CN2C(=O)C=C(C3=CCOCC3)CC2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.01.120 | |||
44299463 | 203323 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 409 | 7 | 1 | 2 | 5.4 | Cc1cc(Br)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL56372 | 203323 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 409 | 7 | 1 | 2 | 5.4 | Cc1cc(Br)cc(COCC(N)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
44290080 | 201636 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 499 | 11 | 2 | 4 | 4.5 | COc1ccc(CC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
CHEMBL539937 | 201636 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 499 | 11 | 2 | 4 | 4.5 | COc1ccc(CC(=O)NC(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2OC)C(C)=O)cc1 | 10.1016/s0960-894x(01)00250-5 | |||
44319356 | 111148 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 607 | 10 | 1 | 6 | 4.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(F)c(F)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
CHEMBL310173 | 111148 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 607 | 10 | 1 | 6 | 4.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(F)c(F)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10013-0 | |||
44415529 | 146805 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 446 | 5 | 2 | 2 | 5.2 | NC(=O)N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
CHEMBL380017 | 146805 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 446 | 5 | 2 | 2 | 5.2 | NC(=O)N[C@H]1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 | 10.1016/j.bmcl.2006.06.035 | |||
24993313 | 193810 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 4 | 1 | 2 | 6.8 | CNC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
CHEMBL490869 | 193810 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 4 | 1 | 2 | 6.8 | CNC(=O)N1C[C@H]2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3)[C@@H]2C1 | 10.1021/jm8016514 | |||
10499846 | 37997 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 1 | 4 | 3.5 | COc1cc(COCC2(c3ccccc3)CCNCC2)cc(OC)c1 | 10.1021/jm980376b | |||
CHEMBL140101 | 37997 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 1 | 4 | 3.5 | COc1cc(COCC2(c3ccccc3)CCNCC2)cc(OC)c1 | 10.1021/jm980376b | |||
130847 | 207359 | 18 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
CHEMBL59915 | 207359 | 18 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 697 | 16 | 4 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 | 10.1021/jm00089a011 | |||
43815 | 193699 | 64 | None | - | 25 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL1708 | 193699 | 64 | None | - | 25 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL490 | 193699 | 64 | None | - | 25 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1016/j.bmc.2013.02.010 | |||
CHEMBL2112245 | 216011 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC1=O | 10.1021/jm000316h | |||||
54581252 | 67926 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 7.0 | Cc1nc(Cl)cc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765496 | 67926 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 486 | 4 | 0 | 2 | 7.0 | Cc1nc(Cl)cc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
11248796 | 168428 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 488 | 4 | 0 | 2 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1cnc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL413027 | 168428 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 488 | 4 | 0 | 2 | 7.2 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1cnc2ccccc2c1-c1ccccc1 | 10.1016/j.bmc.2011.02.031 | |||
44289102 | 175288 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 495 | 8 | 1 | 5 | 5.3 | COc1cc(OC)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
CHEMBL435367 | 175288 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 495 | 8 | 1 | 5 | 5.3 | COc1cc(OC)cc(C(=O)N2CC[C@H](NCc3ccnc4ccccc34)C[C@H]2Cc2ccccc2)c1 | 10.1016/0960-894X(96)00287-9 | |||
76311027 | 112586 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 499 | 6 | 0 | 2 | 7.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
CHEMBL3126969 | 112586 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 499 | 6 | 0 | 2 | 7.6 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCC(N3CCCCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2014.01.036 | |||
18986942 | 210694 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 5 | 1 | 2 | 5.1 | Cc1cc(C)cc(COCC(N)C2c3ccccc3CCc3ccccc32)c1 | 10.1016/S0960-894X(00)80063-3 | |||
CHEMBL69051 | 210694 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 5 | 1 | 2 | 5.1 | Cc1cc(C)cc(COCC(N)C2c3ccccc3CCc3ccccc32)c1 | 10.1016/S0960-894X(00)80063-3 | |||
44299898 | 169908 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 399 | 10 | 1 | 2 | 6.0 | Cc1cc(C)cc(COCC(NCC2CC2)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
CHEMBL417766 | 169908 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 399 | 10 | 1 | 2 | 6.0 | Cc1cc(C)cc(COCC(NCC2CC2)C(c2ccccc2)c2ccccc2)c1 | 10.1016/S0960-894X(01)80531-X | |||
19797414 | 43953 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
CHEMBL145308 | 43953 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 401 | 6 | 0 | 2 | 5.6 | Fc1ccccc1COC1C2CCN(CC2)C1C(c1ccccc1)c1ccccc1 | 10.1021/jm00024a007 | |||
44324681 | 119242 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 592 | 14 | 0 | 4 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
CHEMBL329840 | 119242 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 592 | 14 | 0 | 4 | 5.8 | CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)[C@H](C(=O)N(C)CCN(C)C)C1 | 10.1016/S0960-894X(01)80747-2 | |||
44281769 | 116437 | 7 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 484 | 10 | 4 | 4 | 3.2 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(01)80821-0 | |||
CHEMBL32248 | 116437 | 7 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 484 | 10 | 4 | 4 | 3.2 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(01)80821-0 | |||
44345938 | 18775 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 350 | 7 | 4 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12 | 10.1016/S0960-894X(96)00570-7 | |||
CHEMBL118328 | 18775 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 350 | 7 | 4 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12 | 10.1016/S0960-894X(96)00570-7 | |||
10339539 | 116545 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.3 | CC(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(N)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL323128 | 116545 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 377 | 5 | 1 | 2 | 5.3 | CC(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(N)c1ccccc1 | 10.1016/0960-894X(95)00476-A | |||
CHEMBL2092730 | 215980 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | C[C@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm960281e | |||||
45271306 | 202451 | 0 | None | -645 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL556537 | 202451 | 0 | None | -645 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
46227362 | 209363 | 0 | None | -301 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611926 | 209363 | 0 | None | -301 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
44274254 | 86981 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cccc(Cl)c23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
CHEMBL21366 | 86981 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 507 | 6 | 1 | 3 | 6.4 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)[nH]c3cccc(Cl)c23)CC1 | 10.1016/s0960-894x(01)00182-2 | |||
11661466 | 43690 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL145103 | 43690 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 6 | 0 | 3 | 5.4 | N#Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm00024a007 | |||
CHEMBL2112246 | 216012 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)CN)C(=O)N[C@H]1CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm000316h | |||||
44274444 | 89353 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 597 | 8 | 0 | 4 | 8.0 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(Cc3ccccc3)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
CHEMBL21787 | 89353 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 597 | 8 | 0 | 4 | 8.0 | COc1ccccc1N1CCN(C(=O)CCc2c(-c3ccc(Cl)cc3)n(Cc3ccccc3)c3ccc(Cl)cc23)CC1 | 10.1016/s0960-894x(01)00183-4 | |||
11801586 | 12238 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 591 | 9 | 3 | 4 | 5.2 | CC(=O)Nc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL107502 | 12238 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 591 | 9 | 3 | 4 | 5.2 | CC(=O)Nc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL2112245 | 216011 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSSC[C@H](C(=O)O)NC(=O)[C@H](CO)NC1=O | 10.1021/jm000316h | |||||
CHEMBL2369766 | 216462 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(N)=O | 10.1016/0960-894X(94)85022-4 | |||||
56671764 | 73216 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 423 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817821 | 73216 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 423 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852008 | 73216 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 423 | 5 | 0 | 2 | 6.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2011.07.014 | |||
56671762 | 73234 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 391 | 5 | 0 | 2 | 5.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817820 | 73234 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 391 | 5 | 0 | 2 | 5.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852121 | 73234 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 391 | 5 | 0 | 2 | 5.2 | O=C1CCN(Cc2ccccc2)CC1C(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.07.014 | |||
23025476 | 73249 | 13 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 355 | 5 | 0 | 2 | 4.9 | O=C1CCN(Cc2ccccc2)CC1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1817817 | 73249 | 13 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 355 | 5 | 0 | 2 | 4.9 | O=C1CCN(Cc2ccccc2)CC1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2011.07.014 | |||
CHEMBL1852184 | 73249 | 13 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 355 | 5 | 0 | 2 | 4.9 | O=C1CCN(Cc2ccccc2)CC1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2011.07.014 | |||
2090 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
5311312 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
CHEMBL437797 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00582-E | |||||
44358847 | 36943 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 515 | 10 | 3 | 5 | 5.3 | COc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1OC | 10.1021/jm00022a010 | |||
CHEMBL139017 | 36943 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 515 | 10 | 3 | 5 | 5.3 | COc1ccc(COC(=O)N[C@](C)(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)c2ccccc2)cc1OC | 10.1021/jm00022a010 | |||
54586136 | 67922 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1nccc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
CHEMBL1765492 | 67922 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1nccc(-c2ccccc2)c1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.02.031 | |||
2090 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950892r | |||||
5311312 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950892r | |||||
CHEMBL437797 | 9543 | 25 | None | -309 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950892r | |||||
44375315 | 63281 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
CHEMBL163510 | 63281 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 12 | 4 | 8 | 4.2 | CSCCNS(=O)(=O)c1ccc(N/N=C(\S)N2CCC[C@H]2C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 | 10.1016/s0960-894x(01)00044-0 | |||
44318671 | 112900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 327 | 2 | 1 | 3 | 3.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2ccccc2)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL313432 | 112900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 327 | 2 | 1 | 3 | 3.4 | Fc1ccc([C@@H]2NCCOC23COC[C@H](c2ccccc2)C3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
15037918 | 51628 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 5.2 | Fc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
CHEMBL152239 | 51628 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 5.2 | Fc1ccccc1CN[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(01)81197-5 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 10.5 | pKd | = | 10.5 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 10.5 | pKd | = | 10.5 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 10.5 | pKd | = | 10.5 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 10.5 | pKd | = | 10.5 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
10907397 | 50658 | 0 | None | - | 1 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 515 | 7 | 1 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCC(O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL151177 | 50658 | 0 | None | - | 1 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 515 | 7 | 1 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCC(O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
44366788 | 50929 | 0 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 493 | 6 | 0 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1C1CCCCC1 | 10.1021/jm0209331 | |||
CHEMBL151585 | 50929 | 0 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 493 | 6 | 0 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1C1CCCCC1 | 10.1021/jm0209331 | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
18964186 | 211083 | 0 | None | 3 | 3 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 510 | 8 | 1 | 3 | 6.2 | CN(CC(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL71397 | 211083 | 0 | None | 3 | 3 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 510 | 8 | 1 | 3 | 6.2 | CN(CC(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 | 10.1021/jm0209331 | |||
2102 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
5311057 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
CHEMBL441225 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
21836542 | 49076 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 4.1 | O=C(O)C1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL149794 | 49076 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 4.1 | O=C(O)C1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11005795 | 48960 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1ccccc1CN1CC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CCC1=O | 10.1021/jm0209331 | |||
CHEMBL149690 | 48960 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1ccccc1CN1CC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CCC1=O | 10.1021/jm0209331 | |||
21699577 | 50122 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 536 | 7 | 1 | 3 | 6.4 | O=C1CCC(CCN2CCC(O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL150709 | 50122 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 536 | 7 | 1 | 3 | 6.4 | O=C1CCC(CCN2CCC(O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
10918128 | 126629 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 501 | 7 | 0 | 4 | 4.5 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL348653 | 126629 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 501 | 7 | 0 | 4 | 4.5 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
10973497 | 50011 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 533 | 7 | 0 | 4 | 4.2 | O=C1CCC(CCN2CC(N3CC[S+]([O-])CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL150619 | 50011 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 533 | 7 | 0 | 4 | 4.2 | O=C1CCC(CCN2CC(N3CC[S+]([O-])CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
23224631 | 50691 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 541 | 7 | 1 | 4 | 5.1 | O=C1CCC(CCN2CC(N3C4CCC3CC(O)C4)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL151231 | 50691 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 541 | 7 | 1 | 4 | 5.1 | O=C1CCC(CCN2CC(N3C4CCC3CC(O)C4)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
11071954 | 172117 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 578 | 8 | 0 | 5 | 3.7 | CS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL423584 | 172117 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 578 | 8 | 0 | 5 | 3.7 | CS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
10864234 | 50757 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 517 | 7 | 0 | 4 | 5.2 | O=C1CCC(CCN2CC(N3CCSCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL151317 | 50757 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 517 | 7 | 0 | 4 | 5.2 | O=C1CCC(CCN2CC(N3CCSCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
10929285 | 73483 | 0 | None | 1 | 2 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CC[C@](CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
CHEMBL185572 | 73483 | 0 | None | 1 | 2 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CC[C@](CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
21836537 | 48138 | 10 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 543 | 8 | 1 | 5 | 2.2 | NS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL148998 | 48138 | 10 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 543 | 8 | 1 | 5 | 2.2 | NS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
44366712 | 50277 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 477 | 7 | 0 | 4 | 4.0 | O=C1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL150842 | 50277 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 477 | 7 | 0 | 4 | 4.0 | O=C1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11028028 | 50445 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 549 | 7 | 0 | 5 | 3.9 | O=C1CCC(CCN2CC(N3CCS(=O)(=O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL150997 | 50445 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 549 | 7 | 0 | 5 | 3.9 | O=C1CCC(CCN2CC(N3CCS(=O)(=O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
11060266 | 50919 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
CHEMBL151570 | 50919 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
10984417 | 50554 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 4.3 | CC(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL151088 | 50554 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 4.3 | CC(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
44366743 | 50739 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 479 | 7 | 1 | 4 | 3.8 | O=C1CCC(CCN2CC(N3CCC(O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
CHEMBL151289 | 50739 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 479 | 7 | 1 | 4 | 3.8 | O=C1CCC(CCN2CC(N3CCC(O)CC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
11813113 | 49910 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 501 | 7 | 1 | 4 | 4.2 | O=C1CCC(CCN2CC(N3CCC(O)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL150537 | 49910 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 501 | 7 | 1 | 4 | 4.2 | O=C1CCC(CCN2CC(N3CCC(O)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
11827396 | 49981 | 1 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 515 | 7 | 1 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCCC(O)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL150585 | 49981 | 1 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 515 | 7 | 1 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCCC(O)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
21836550 | 126261 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 478 | 7 | 1 | 4 | 3.8 | NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL345309 | 126261 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 478 | 7 | 1 | 4 | 3.8 | NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11071343 | 128295 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.9 | O=C1CCC(CCN2CC(N3CCCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL358418 | 128295 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.9 | O=C1CCC(CCN2CC(N3CCCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
44366283 | 46314 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 571 | 9 | 0 | 5 | 2.8 | CN(C)S(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL147301 | 46314 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 571 | 9 | 0 | 5 | 2.8 | CN(C)S(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11103819 | 126257 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 577 | 8 | 0 | 4 | 6.2 | O=C1CCC(CCN2CC(N3CCOC(c4ccccc4)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL345288 | 126257 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 577 | 8 | 0 | 4 | 6.2 | O=C1CCC(CCN2CC(N3CCOC(c4ccccc4)C3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
21836558 | 128063 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 556 | 9 | 1 | 5 | 3.4 | CS(=O)(=O)NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL357946 | 128063 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 556 | 9 | 1 | 5 | 3.4 | CS(=O)(=O)NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11123982 | 50959 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7 | Binding | ChEMBL | 502 | 7 | 0 | 5 | 3.9 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccncc1 | 10.1021/jm0209331 | |||
CHEMBL151621 | 50959 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7 | Binding | ChEMBL | 502 | 7 | 0 | 5 | 3.9 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccncc1 | 10.1021/jm0209331 | |||
44300138 | 107674 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 567 | 9 | 6 | 3 | 5.6 | N=C(N)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL293804 | 107674 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 567 | 9 | 6 | 3 | 5.6 | N=C(N)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
21836503 | 48726 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 464 | 7 | 1 | 4 | 3.2 | O=C1CCC(CCN2CC(N3CCNCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
CHEMBL149469 | 48726 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 464 | 7 | 1 | 4 | 3.2 | O=C1CCC(CCN2CC(N3CCNCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
44300056 | 107613 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 630 | 17 | 3 | 2 | 9.9 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL293374 | 107613 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 630 | 17 | 3 | 2 | 9.9 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL555235 | 107613 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 630 | 17 | 3 | 2 | 9.9 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
44300032 | 205873 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 525 | 8 | 4 | 3 | 6.0 | NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL58873 | 205873 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 525 | 8 | 4 | 3 | 6.0 | NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
52937467 | 69297 | 0 | None | -9 | 3 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL1782141 | 69297 | 0 | None | -9 | 3 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
21836538 | 46261 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 520 | 8 | 1 | 4 | 3.9 | CC(=O)NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL147241 | 46261 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 520 | 8 | 1 | 4 | 3.9 | CC(=O)NC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
10864203 | 50472 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 514 | 7 | 0 | 4 | 4.4 | CN1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL151026 | 50472 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 514 | 7 | 0 | 4 | 4.4 | CN1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(Cc4ccccc4)C3)C2)CC1 | 10.1021/jm0209331 | |||
44300037 | 198711 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 681 | 14 | 7 | 5 | 4.6 | NC(N)=NCCC[C@H](N)C(=O)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL52004 | 198711 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 681 | 14 | 7 | 5 | 4.6 | NC(N)=NCCC[C@H](N)C(=O)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
71452185 | 90310 | 0 | None | -2 | 2 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203707 | 90310 | 0 | None | -2 | 2 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44300106 | 205058 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 623 | 11 | 5 | 3 | 6.7 | CC/N=C(\NCC)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL57584 | 205058 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 623 | 11 | 5 | 3 | 6.7 | CC/N=C(\NCC)NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
11135103 | 128352 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 519 | 7 | 0 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccc(F)cc1 | 10.1021/jm0209331 | |||
CHEMBL358600 | 128352 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 519 | 7 | 0 | 4 | 4.6 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccc(F)cc1 | 10.1021/jm0209331 | |||
11113999 | 50641 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.0 | O=C1CCC(CCN2CC(N3CCOCC3=O)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL151155 | 50641 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.0 | O=C1CCC(CCN2CC(N3CCOCC3=O)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
11763019 | 126468 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1cccc(CN2CC(CCN3CC(N4CCOCC4)C3)(c3ccc(Cl)c(Cl)c3)CCC2=O)c1 | 10.1021/jm0209331 | |||
CHEMBL347284 | 126468 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1cccc(CN2CC(CCN3CC(N4CCOCC4)C3)(c3ccc(Cl)c(Cl)c3)CCC2=O)c1 | 10.1021/jm0209331 | |||
44241710 | 90306 | 1 | None | 3 | 2 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203703 | 90306 | 1 | None | 3 | 2 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44300497 | 107535 | 0 | None | - | 1 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 695 | 18 | 3 | 2 | 10.3 | CCCC[N+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL292816 | 107535 | 0 | None | - | 1 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 695 | 18 | 3 | 2 | 10.3 | CCCC[N+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
22901331 | 18753 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
54435601 | 18753 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
59922977 | 18753 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL1183068 | 18753 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
CHEMBL278294 | 18753 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 424 | 4 | 0 | 4 | 5.2 | CCn1c(/C=C/C=C2\N(C)c3ccccc3C2(C)C)[n+](CC)c2nc3ccccc3nc21 | 10.1021/jm00109a034 | |||
11071001 | 49745 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 489 | 9 | 1 | 4 | 4.1 | CN(CCO)C1CN(CCC2(c3ccc(Cl)c(Cl)c3)CCC(=O)N(Cc3ccccc3)C2)C1 | 10.1021/jm0209331 | |||
CHEMBL150381 | 49745 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 489 | 9 | 1 | 4 | 4.1 | CN(CCO)C1CN(CCC2(c3ccc(Cl)c(Cl)c3)CCC(=O)N(Cc3ccccc3)C2)C1 | 10.1021/jm0209331 | |||
44366988 | 50781 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 596 | 9 | 1 | 4 | 5.5 | CC(=O)NC1(c2ccccc2)CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL151356 | 50781 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 596 | 9 | 1 | 4 | 5.5 | CC(=O)NC1(c2ccccc2)CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
44366559 | 126309 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 557 | 9 | 1 | 5 | 2.4 | CNS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL345733 | 126309 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 557 | 9 | 1 | 5 | 2.4 | CNS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
44366577 | 127889 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 542 | 8 | 0 | 5 | 2.9 | CS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL357357 | 127889 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 542 | 8 | 0 | 5 | 2.9 | CS(=O)(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
52937271 | 69295 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL1782139 | 69295 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
118730933 | 124935 | 0 | None | -389 | 2 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408519 | 124935 | 0 | None | -389 | 2 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
6604943 | 108517 | 1 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 712 | 18 | 3 | 2 | 11.5 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N/C(=N\C2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL299701 | 108517 | 1 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 712 | 18 | 3 | 2 | 11.5 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N/C(=N\C2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL555236 | 108517 | 1 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 712 | 18 | 3 | 2 | 11.5 | CCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N/C(=N\C2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
44300034 | 205284 | 0 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 569 | 9 | 5 | 4 | 5.7 | NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)c(C(=O)O)c1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL57778 | 205284 | 0 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 569 | 9 | 5 | 4 | 5.7 | NCc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)c(C(=O)O)c1 | 10.1016/S0960-894X(97)00328-4 | |||
71457524 | 90308 | 0 | None | -5 | 2 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203705 | 90308 | 0 | None | -5 | 2 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
10864032 | 50475 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 500 | 7 | 1 | 4 | 4.0 | O=C1CCC(CCN2CC(N3CCNCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
CHEMBL151028 | 50475 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 500 | 7 | 1 | 4 | 4.0 | O=C1CCC(CCN2CC(N3CCNCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccccc1 | 10.1021/jm0209331 | |||
21836496 | 127670 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 507 | 7 | 1 | 4 | 3.0 | NC(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL355973 | 127670 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 507 | 7 | 1 | 4 | 3.0 | NC(=O)N1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
118730934 | 124936 | 0 | None | -363 | 2 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 835 | 15 | 6 | 7 | 4.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408520 | 124936 | 0 | None | -363 | 2 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 835 | 15 | 6 | 7 | 4.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44300055 | 107782 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 695 | 18 | 3 | 2 | 10.3 | CCCC[N+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL294452 | 107782 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 695 | 18 | 3 | 2 | 10.3 | CCCC[N+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
11813288 | 50048 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1ccc(CN2CC(CCN3CC(N4CCOCC4)C3)(c3ccc(Cl)c(Cl)c3)CCC2=O)cc1 | 10.1021/jm0209331 | |||
CHEMBL150644 | 50048 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 515 | 7 | 0 | 4 | 4.8 | Cc1ccc(CN2CC(CCN3CC(N4CCOCC4)C3)(c3ccc(Cl)c(Cl)c3)CCC2=O)cc1 | 10.1021/jm0209331 | |||
44366742 | 50738 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 507 | 9 | 0 | 4 | 4.8 | CCOC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
CHEMBL151288 | 50738 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 507 | 9 | 0 | 4 | 4.8 | CCOC1CCN(C2CN(CCC3(c4ccc(Cl)c(Cl)c4)CCC(=O)N(CC4CC4)C3)C2)CC1 | 10.1021/jm0209331 | |||
11103197 | 85188 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CC[C@@](CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
CHEMBL2111193 | 85188 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 507 | 7 | 0 | 4 | 4.8 | O=C1CC[C@@](CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCC1 | 10.1021/jm0209331 | |||
132927 | 10856 | 4 | None | -6 | 2 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 746 | 18 | 3 | 2 | 8.5 | CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-] | 10.1016/S0960-894X(97)00328-4 | |||
138398059 | 10856 | 4 | None | -6 | 2 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 746 | 18 | 3 | 2 | 8.5 | CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-] | 10.1016/S0960-894X(97)00328-4 | |||
677 | 10856 | 4 | None | -6 | 2 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 746 | 18 | 3 | 2 | 8.5 | CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-] | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL294453 | 10856 | 4 | None | -6 | 2 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 746 | 18 | 3 | 2 | 8.5 | CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-] | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL551291 | 10856 | 4 | None | -6 | 2 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 746 | 18 | 3 | 2 | 8.5 | CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-] | 10.1016/S0960-894X(97)00328-4 | |||
9847362 | 128467 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 465 | 7 | 0 | 4 | 3.7 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
CHEMBL358694 | 128467 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 465 | 7 | 0 | 4 | 3.7 | O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CC1 | 10.1021/jm0209331 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
44300139 | 205822 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 567 | 9 | 6 | 3 | 5.6 | N=C(N)NCc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
CHEMBL58598 | 205822 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 567 | 9 | 6 | 3 | 5.6 | N=C(N)NCc1ccc(NC(=O)[C@@H](Cc2ccc3ccccc3c2)N=C(NC2CCCCC2)NC2CCCCC2)cc1 | 10.1016/S0960-894X(97)00328-4 | |||
118730932 | 124934 | 0 | None | -2951 | 2 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 834 | 15 | 7 | 7 | 3.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408518 | 124934 | 0 | None | -2951 | 2 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 834 | 15 | 7 | 7 | 3.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
10288987 | 24986 | 0 | None | - | 1 | Human | 11.0 | pKi | = | 11 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | nan | |||
CHEMBL1270066 | 24986 | 0 | None | - | 1 | Human | 11.0 | pKi | = | 11 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | nan | |||
122187724 | 129844 | 0 | None | 17 | 4 | Human | 10.8 | pKi | = | 10.8 | Binding | ChEMBL | 692 | 11 | 5 | 6 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3609620 | 129844 | 0 | None | 17 | 4 | Human | 10.8 | pKi | = | 10.8 | Binding | ChEMBL | 692 | 11 | 5 | 6 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
10216430 | 86680 | 0 | None | 204173 | 2 | Human | 10.7 | pKi | = | 10.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | C[C@@H](OCC1(c2ccccc2)CC(N)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL212428 | 86680 | 0 | None | 204173 | 2 | Human | 10.7 | pKi | = | 10.7 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | C[C@@H](OCC1(c2ccccc2)CC(N)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
5752 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/j.bmc.2011.08.070 | |||
6918331 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/j.bmc.2011.08.070 | |||
CHEMBL522302 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/j.bmc.2011.08.070 | |||
DB12436 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/j.bmc.2011.08.070 | |||
5752 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/0960-894X(96)00163-1 | |||
6918331 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL522302 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/0960-894X(96)00163-1 | |||
DB12436 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL3609617 | 218610 | 0 | None | 501 | 4 | Human | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
10714695 | 48810 | 0 | None | - | 1 | Human | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 378 | 6 | 2 | 4 | 5.0 | COc1ccc(-c2ccsc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL149557 | 48810 | 0 | None | - | 1 | Human | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 378 | 6 | 2 | 4 | 5.0 | COc1ccc(-c2ccsc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
9852175 | 84991 | 15 | None | 1 | 3 | Mongolian jird | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2105667 | 84991 | 15 | None | 1 | 3 | Mongolian jird | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2419537 | 217217 | 0 | None | 32 | 4 | Human | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
44264764 | 19959 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 406 | 8 | 2 | 7 | 3.2 | CCCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1191008 | 19959 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 406 | 8 | 2 | 7 | 3.2 | CCCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL542044 | 19959 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 406 | 8 | 2 | 7 | 3.2 | CCCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
22880695 | 20358 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 410 | 7 | 2 | 8 | 3.0 | COc1ccc(-n2nnnc2SC)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1194085 | 20358 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 410 | 7 | 2 | 8 | 3.0 | COc1ccc(-n2nnnc2SC)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL545594 | 20358 | 0 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 410 | 7 | 2 | 8 | 3.0 | COc1ccc(-n2nnnc2SC)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
127944 | 127703 | 3 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL356062 | 127703 | 3 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL555572 | 127703 | 3 | None | - | 1 | Human | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL3608939 | 218607 | 0 | None | 1 | 3 | Rat | 10.4 | pKi | = | 10.4 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
CHEMBL261390 | 217297 | 0 | None | 34 | 3 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||||
44177770 | 129780 | 0 | None | 31 | 4 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 939 | 20 | 8 | 9 | 4.1 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3608937 | 129780 | 0 | None | 31 | 4 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 939 | 20 | 8 | 9 | 4.1 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
10500669 | 45850 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 391 | 6 | 2 | 5 | 4.6 | COc1ccc(-c2c(C)noc2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL146885 | 45850 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 391 | 6 | 2 | 5 | 4.6 | COc1ccc(-c2c(C)noc2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10809458 | 126165 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 374 | 5 | 2 | 3 | 4.0 | COc1ccc(Br)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL344536 | 126165 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 374 | 5 | 2 | 3 | 4.0 | COc1ccc(Br)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
127944 | 127703 | 3 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL356062 | 127703 | 3 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL555572 | 127703 | 3 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2cnnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
5752 | 10777 | 24 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm900023b | |||
6918331 | 10777 | 24 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm900023b | |||
CHEMBL522302 | 10777 | 24 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm900023b | |||
DB12436 | 10777 | 24 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 10.1021/jm900023b | |||
44264847 | 19594 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.6 | COc1ccc(-n2nnnc2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1188354 | 19594 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.6 | COc1ccc(-n2nnnc2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL536103 | 19594 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.6 | COc1ccc(-n2nnnc2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
44264766 | 20327 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 392 | 7 | 2 | 7 | 2.8 | CCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1193883 | 20327 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 392 | 7 | 2 | 7 | 2.8 | CCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL545360 | 20327 | 0 | None | - | 1 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 392 | 7 | 2 | 7 | 2.8 | CCc1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
45271306 | 202451 | 0 | None | 14 | 4 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL556537 | 202451 | 0 | None | 14 | 4 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
11793012 | 127825 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 362 | 6 | 2 | 4 | 4.5 | COc1ccc(-c2ccoc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL356786 | 127825 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 362 | 6 | 2 | 4 | 4.5 | COc1ccc(-c2ccoc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10499614 | 128756 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 373 | 6 | 2 | 4 | 4.3 | COc1ccc(-c2ccncc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL359188 | 128756 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 373 | 6 | 2 | 4 | 4.3 | COc1ccc(-c2ccncc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
9852175 | 84991 | 15 | None | -1 | 3 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2105667 | 84991 | 15 | None | -1 | 3 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
22880684 | 20267 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 442 | 7 | 2 | 9 | 1.7 | COc1ccc(-n2nnnc2S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1193478 | 20267 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 442 | 7 | 2 | 9 | 1.7 | COc1ccc(-n2nnnc2S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL544891 | 20267 | 0 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 442 | 7 | 2 | 9 | 1.7 | COc1ccc(-n2nnnc2S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
24969015 | 99752 | 7 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2441373 | 99752 | 7 | None | - | 1 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCN3C(=O)CC[C@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2419538 | 217218 | 0 | None | 75 | 4 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NC1(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCC1 | 10.1016/j.bmcl.2013.06.065 | |||||
44177570 | 68034 | 0 | None | 15 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766204 | 68034 | 0 | None | 15 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44233185 | 201601 | 0 | None | 47 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL539193 | 201601 | 0 | None | 47 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2013.12.033 | |||
10641076 | 175196 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 342 | 6 | 2 | 4 | 4.0 | COc1ccc(SC)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL434884 | 175196 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 342 | 6 | 2 | 4 | 4.0 | COc1ccc(SC)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10152974 | 64642 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 519 | 4 | 0 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1C[C@@H](N(C)C)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672044 | 64642 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 519 | 4 | 0 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1C[C@@H](N(C)C)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
15463537 | 20769 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 404 | 7 | 2 | 7 | 3.1 | COc1ccc(-n2nnnc2C2CC2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1197007 | 20769 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 404 | 7 | 2 | 7 | 3.1 | COc1ccc(-n2nnnc2C2CC2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL558990 | 20769 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 404 | 7 | 2 | 7 | 3.1 | COc1ccc(-n2nnnc2C2CC2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
51002938 | 64645 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 531 | 4 | 0 | 2 | 6.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCC2)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672047 | 64645 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 531 | 4 | 0 | 2 | 6.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCC2)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL389652 | 219209 | 0 | None | 2 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
CHEMBL389652 | 219209 | 0 | None | 2 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||||
CHEMBL2419542 | 217222 | 0 | None | 6 | 3 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
CHEMBL2419541 | 217221 | 0 | None | 3 | 4 | Human | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
CHEMBL2419543 | 217223 | 0 | None | 16 | 4 | Human | 10.0 | pKi | = | 10.0 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
9871118 | 152910 | 0 | None | - | 1 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 514 | 6 | 2 | 5 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](n2cn[nH]c2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3919618 | 152910 | 0 | None | - | 1 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 514 | 6 | 2 | 5 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](n2cn[nH]c2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
2109 | 10909 | 4 | None | 5 | 3 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1016/s0960-894x(01)00572-8 | |||
9852253 | 10909 | 4 | None | 5 | 3 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1016/s0960-894x(01)00572-8 | |||
CHEMBL129683 | 10909 | 4 | None | 5 | 3 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1016/s0960-894x(01)00572-8 | |||
10173872 | 146051 | 0 | None | 6309 | 2 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.0 | CC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL379072 | 146051 | 0 | None | 6309 | 2 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.0 | CC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
46227362 | 209363 | 0 | None | 12 | 4 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611926 | 209363 | 0 | None | 12 | 4 | Human | 10.0 | pKi | = | 10 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
51002993 | 64651 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 602 | 4 | 0 | 3 | 6.1 | CC(=O)N1CCN([C@H]2CCN(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1021/jm1013264 | |||
CHEMBL1672053 | 64651 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 602 | 4 | 0 | 3 | 6.1 | CC(=O)N1CCN([C@H]2CCN(C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1021/jm1013264 | |||
CHEMBL3609616 | 218609 | 0 | None | 1 | 4 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
CHEMBL2419539 | 217219 | 0 | None | 25 | 4 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
2109 | 10909 | 4 | None | 5 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1021/jm020094i | |||
9852253 | 10909 | 4 | None | 5 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1021/jm020094i | |||
CHEMBL129683 | 10909 | 4 | None | 5 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 631 | 9 | 0 | 4 | 7.9 | N#Cc1cc2ccccc2c(c1)C(=O)N(C[C@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)c1ccccc1[S@@](=O)C)C | 10.1021/jm020094i | |||
10546738 | 172387 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2ncnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL424301 | 172387 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.3 | COc1ccc(-n2ncnn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
23725089 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
4401 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
5758 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
9917021 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
CHEMBL1672054 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
DB06634 | 7591 | 13 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
72203985 | 99750 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCN3C(=O)CC[C@@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2441371 | 99750 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCN3C(=O)CC[C@@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL1651026 | 215605 | 24 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1016/j.ejmech.2013.01.044 | |||||
9961315 | 124702 | 0 | None | 2 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 661 | 10 | 0 | 5 | 7.9 | COc1ccc(C2CCN(CC[C@H](CN(C)C(=O)c3cc(C#N)cc4ccccc34)c3ccc(Cl)c(Cl)c3)CC2)c([S@+](C)[O-])c1 | 10.1021/jm020094i | |||
CHEMBL340326 | 124702 | 0 | None | 2 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 661 | 10 | 0 | 5 | 7.9 | COc1ccc(C2CCN(CC[C@H](CN(C)C(=O)c3cc(C#N)cc4ccccc34)c3ccc(Cl)c(Cl)c3)CC2)c([S@+](C)[O-])c1 | 10.1021/jm020094i | |||
51003118 | 64649 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 559 | 4 | 0 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672051 | 64649 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 559 | 4 | 0 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL3609616 | 218609 | 0 | None | -1 | 4 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
10288987 | 24986 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270066 | 24986 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
10495476 | 46685 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 314 | 5 | 2 | 3 | 3.4 | COc1ccc(F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL147776 | 46685 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 314 | 5 | 2 | 3 | 3.4 | COc1ccc(F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10643148 | 128322 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 374 | 6 | 2 | 5 | 3.7 | COc1ccc(-c2cncnc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL358575 | 128322 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 374 | 6 | 2 | 5 | 3.7 | COc1ccc(-c2cncnc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10784942 | 128768 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 2.9 | COc1ccc(-n2cncn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL359255 | 128768 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 2.9 | COc1ccc(-n2cncn2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
51002996 | 64655 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 559 | 5 | 1 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](NC2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672058 | 64655 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 559 | 5 | 1 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@@H](NC2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
2102 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
5311057 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
CHEMBL441225 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
105083 | 32223 | 3 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CNC1CCCN[C@H]1c1ccccc1 | 10.1021/jm00051a001 | |||
CHEMBL135022 | 32223 | 3 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CNC1CCCN[C@H]1c1ccccc1 | 10.1021/jm00051a001 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
9809876 | 26172 | 1 | None | 398 | 3 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 661 | 10 | 0 | 5 | 7.9 | COc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm020094i | |||
CHEMBL129321 | 26172 | 1 | None | 398 | 3 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 661 | 10 | 0 | 5 | 7.9 | COc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm020094i | |||
51003056 | 64646 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672048 | 64646 | 0 | None | - | 1 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
49863732 | 22103 | 0 | None | 24 | 4 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
CHEMBL1214025 | 22103 | 0 | None | 24 | 4 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 1266 | 18 | 10 | 12 | 6.1 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC1(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm100157m | |||
10217362 | 25066 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@H](C(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270565 | 25066 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@H](C(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
10547681 | 127856 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.5 | COc1ccc(-c2nnnn2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL357029 | 127856 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.5 | COc1ccc(-c2nnnn2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
21041073 | 145627 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL378156 | 145627 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
51003119 | 64650 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 559 | 4 | 0 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672052 | 64650 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 559 | 4 | 0 | 2 | 7.6 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
53320128 | 64653 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 505 | 4 | 1 | 2 | 6.1 | CN[C@H]1CCN(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1021/jm1013264 | |||
CHEMBL1672056 | 64653 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 505 | 4 | 1 | 2 | 6.1 | CN[C@H]1CCN(C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1021/jm1013264 | |||
10290124 | 99751 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
CHEMBL2441372 | 99751 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 628 | 4 | 0 | 3 | 6.8 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCN3C(=O)CC[C@@H]3C2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2013.09.001 | |||
10289148 | 153890 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 502 | 5 | 2 | 4 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@]2(CN1)COC(=O)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3927453 | 153890 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 502 | 5 | 2 | 4 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@]2(CN1)COC(=O)N2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3609618 | 218611 | 0 | None | 16 | 4 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
44560810 | 180054 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452534 | 180054 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
9958115 | 180278 | 0 | None | 6309 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL453054 | 180278 | 0 | None | 6309 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
44560811 | 195772 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](N2CCCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL508661 | 195772 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](N2CCCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
11327981 | 189057 | 14 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 434 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)[C@](C)(C(F)(F)F)OCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL478392 | 189057 | 14 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 434 | 5 | 2 | 4 | 4.6 | COc1cc2c(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)[C@](C)(C(F)(F)F)OCC2 | 10.1016/j.bmc.2008.06.047 | |||
CHEMBL229280 | 216237 | 0 | None | 23 | 3 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC[S+](C)[O-])NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
51003053 | 64656 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 563 | 7 | 1 | 3 | 6.7 | COCCN[C@H]1CCN(C(=O)N(C)[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1021/jm1013264 | |||
CHEMBL1672059 | 64656 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 563 | 7 | 1 | 3 | 6.7 | COCCN[C@H]1CCN(C(=O)N(C)[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2C)C1 | 10.1021/jm1013264 | |||
44177669 | 68035 | 0 | None | 2 | 4 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766205 | 68035 | 0 | None | 2 | 4 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
10217361 | 25065 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](C(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270564 | 25065 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](C(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm1013264 | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm1013264 | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm1013264 | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm1013264 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1021/jm900023b | |||
10289302 | 25006 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC(=O)C2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270175 | 25006 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC(=O)C2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
9872808 | 64643 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 2 | 7.1 | Cc1cc(F)ccc1[C@H]1C[C@@H](N(C)C)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672045 | 64643 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 533 | 4 | 0 | 2 | 7.1 | Cc1cc(F)ccc1[C@H]1C[C@@H](N(C)C)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
46227363 | 206444 | 0 | None | 28 | 4 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL592969 | 206444 | 0 | None | 28 | 4 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmcl.2009.11.078 | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmcl.2009.11.078 | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 10.1016/j.bmcl.2009.11.078 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
10598278 | 20696 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 421 | 7 | 3 | 8 | 2.2 | COc1ccc(-n2nnnc2NC(C)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1196442 | 20696 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 421 | 7 | 3 | 8 | 2.2 | COc1ccc(-n2nnnc2NC(C)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL556981 | 20696 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 421 | 7 | 3 | 8 | 2.2 | COc1ccc(-n2nnnc2NC(C)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
52943331 | 25021 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 6.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](N2CCCC2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270271 | 25021 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 6.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](N2CCCC2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
52947014 | 25078 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.4 | CNC(=O)[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270664 | 25078 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.4 | CNC(=O)[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
2102 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
5311057 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
CHEMBL441225 | 7972 | 21 | None | 2 | 2 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00073a022 | |||
9852904 | 123815 | 0 | None | 34 | 3 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 677 | 10 | 1 | 6 | 5.9 | CNC(=O)C1(N2CCCCC2=O)CCN(CC[C@H](CN(C)C(=O)c2c(OC)c(C#N)cc3ccccc23)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm020094i | |||
CHEMBL339051 | 123815 | 0 | None | 34 | 3 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 677 | 10 | 1 | 6 | 5.9 | CNC(=O)C1(N2CCCCC2=O)CCN(CC[C@H](CN(C)C(=O)c2c(OC)c(C#N)cc3ccccc23)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm020094i | |||
51002992 | 64648 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.0 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672050 | 64648 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.0 | Cc1cc(F)ccc1[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
122187724 | 129844 | 0 | None | -17 | 4 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 692 | 11 | 5 | 6 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3609620 | 129844 | 0 | None | -17 | 4 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 692 | 11 | 5 | 6 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
52940937 | 25049 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.4 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC2=NCCO2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270465 | 25049 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.4 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC2=NCCO2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
10152358 | 25005 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 6.0 | CCC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270174 | 25005 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 6.0 | CCC(=O)N[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL389652 | 219209 | 0 | None | 2 | 4 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
CHEMBL389652 | 219209 | 0 | None | -2 | 4 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||||
CHEMBL2419541 | 217221 | 0 | None | -3 | 4 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
CHEMBL389652 | 219209 | 0 | None | -2 | 4 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
153996 | 119445 | 2 | None | 3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(01)00572-8 | |||
CHEMBL330366 | 119445 | 2 | None | 3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(01)00572-8 | |||
CHEMBL539021 | 119445 | 2 | None | 3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(01)00572-8 | |||
9831546 | 211954 | 0 | None | -1 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 698 | 12 | 1 | 6 | 5.6 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL78284 | 211954 | 0 | None | -1 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 698 | 12 | 1 | 6 | 5.6 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL2397481 | 217195 | 5 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||||
11712457 | 25122 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.5 | C[C@@H](OC[C@@]1(c2ccccc2)CCCCN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270970 | 25122 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 6.5 | C[C@@H](OC[C@@]1(c2ccccc2)CCCCN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL2397481 | 217195 | 5 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2018.06.009 | |||||
10128086 | 86601 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 6.5 | C[C@@H](OC[C@]1(c2ccccc2)C[C@H](N2CCCC2=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL212112 | 86601 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 6.5 | C[C@@H](OC[C@]1(c2ccccc2)C[C@H](N2CCCC2=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
10128366 | 87039 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 507 | 8 | 1 | 2 | 7.7 | C[C@@H](OCC1(c2ccccc2)CC(NCc2ccccc2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL213906 | 87039 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 507 | 8 | 1 | 2 | 7.7 | C[C@@H](OCC1(c2ccccc2)CC(NCc2ccccc2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
10128322 | 179751 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.1 | CCC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL451765 | 179751 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.1 | CCC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
10311126 | 179978 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 4.7 | CC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452270 | 179978 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 4.7 | CC(=O)N[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
44560775 | 180052 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.1 | CCC(=O)N[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452532 | 180052 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.1 | CCC(=O)N[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
44241723 | 90307 | 0 | None | 12 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 674 | 6 | 0 | 5 | 6.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)[C@@H](C)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203704 | 90307 | 0 | None | 12 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 674 | 6 | 0 | 5 | 6.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)[C@@H](C)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
10603544 | 117341 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 592 | 9 | 2 | 5 | 5.0 | COC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL325312 | 117341 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 592 | 9 | 2 | 5 | 5.0 | COC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
51002995 | 64654 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 545 | 5 | 1 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@@H](NC2CC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672057 | 64654 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 545 | 5 | 1 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@@H](NC2CC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
52945787 | 25048 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 524 | 7 | 2 | 5 | 6.4 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](Nc2ncccn2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270464 | 25048 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 524 | 7 | 2 | 5 | 6.4 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](Nc2ncccn2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
23725089 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
4401 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
5758 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
9917021 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
CHEMBL1672054 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
DB06634 | 7591 | 13 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 10.1021/jm1013264 | |||
122187205 | 129781 | 0 | None | 1 | 4 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 981 | 22 | 8 | 9 | 5.3 | CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3608938 | 129781 | 0 | None | 1 | 4 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 981 | 22 | 8 | 9 | 5.3 | CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
52942011 | 25108 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](C(=O)NC2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270868 | 25108 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](C(=O)NC2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
52943450 | 24987 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270067 | 24987 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.6 | CC(=O)N[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
52946917 | 25093 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.8 | CCNC(=O)[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270766 | 25093 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.8 | CCNC(=O)[C@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
10174642 | 153326 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 516 | 5 | 2 | 4 | 5.9 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CCOC(=O)N2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3922759 | 153326 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 516 | 5 | 2 | 4 | 5.9 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CCOC(=O)N2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00581-D | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00581-D | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00581-D | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00552-5 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00552-5 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00552-5 | |||
44408025 | 82690 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204979 | 82690 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
10363623 | 91654 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 400 | 7 | 2 | 4 | 4.5 | COc1ccc(C(=O)c2ccccc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
CHEMBL22360 | 91654 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 400 | 7 | 2 | 4 | 4.5 | COc1ccc(C(=O)c2ccccc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
15463538 | 20679 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 440 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2-c2ccccc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1196327 | 20679 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 440 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2-c2ccccc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL556562 | 20679 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 440 | 7 | 2 | 7 | 3.9 | COc1ccc(-n2nnnc2-c2ccccc2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
102023780 | 127525 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10417302 | 127525 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380072 | 127525 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL355041 | 127525 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9852630 | 211632 | 0 | None | 1 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 655 | 10 | 0 | 5 | 6.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL75598 | 211632 | 0 | None | 1 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 655 | 10 | 0 | 5 | 6.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
22960738 | 82059 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 533 | 6 | 1 | 3 | 5.4 | CN1CCC(N2CC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccc(F)cc3)NC2=O)CC1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL203716 | 82059 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 533 | 6 | 1 | 3 | 5.4 | CN1CCC(N2CC(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)(c3ccc(F)cc3)NC2=O)CC1 | 10.1016/j.bmcl.2005.10.072 | |||
10164354 | 172780 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 507 | 7 | 2 | 3 | 4.3 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CN(CC(N)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL425406 | 172780 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 507 | 7 | 2 | 3 | 4.3 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CN(CC(N)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
18403344 | 147692 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 579 | 5 | 1 | 4 | 7.0 | Cc1ccccc1-c1cc(N2CCC(O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL382242 | 147692 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 579 | 5 | 1 | 4 | 7.0 | Cc1ccccc1-c1cc(N2CCC(O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
52942012 | 25109 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@H](C(=O)NC2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270869 | 25109 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 514 | 7 | 2 | 3 | 6.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@@H](C(=O)NC2CC2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
10173872 | 146052 | 0 | None | 5370 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.0 | CC(=O)N[C@H]1C[C@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL379073 | 146052 | 0 | None | 5370 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 459 | 6 | 1 | 2 | 6.0 | CC(=O)N[C@H]1C[C@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
10128086 | 146302 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 6.5 | C[C@@H](OC[C@]1(c2ccccc2)C[C@@H](N2CCCC2=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL379520 | 146302 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 485 | 6 | 0 | 2 | 6.5 | C[C@@H](OC[C@]1(c2ccccc2)C[C@@H](N2CCCC2=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
44560832 | 183592 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 5.7 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCC2)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL460890 | 183592 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 5.7 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](N2CCCC2)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
44560834 | 196776 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 446 | 5 | 2 | 3 | 4.5 | C[C@@H](OC[C@@]1(c2ccccc2)CC(N)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL517121 | 196776 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 446 | 5 | 2 | 3 | 4.5 | C[C@@H](OC[C@@]1(c2ccccc2)CC(N)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm2017072 | |||
11490769 | 90311 | 0 | None | 6 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 660 | 6 | 0 | 5 | 6.3 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203708 | 90311 | 0 | None | 6 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 660 | 6 | 0 | 5 | 6.3 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
9874473 | 48582 | 0 | None | 16 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
CHEMBL149326 | 48582 | 0 | None | 16 | 3 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
44307758 | 210335 | 0 | None | 1 | 2 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL66635 | 210335 | 0 | None | 1 | 2 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
10311483 | 151651 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 514 | 5 | 2 | 3 | 6.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CCCC(=O)N2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3909899 | 151651 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 514 | 5 | 2 | 3 | 6.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CCCC(=O)N2)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL2370435 | 216628 | 0 | None | 48 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1021/jm8007618 | |||||
44140365 | 193818 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL490926 | 193818 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
10173890 | 85020 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 460 | 6 | 2 | 3 | 4.7 | C[C@@H](OC[C@]1(c2ccccc2)C[C@@](N)(C(N)=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL210641 | 85020 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 460 | 6 | 2 | 3 | 4.7 | C[C@@H](OC[C@]1(c2ccccc2)C[C@@](N)(C(N)=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
51003178 | 64652 | 6 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | CC(=O)N1CCN([C@@H]2CCN(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1021/jm1013264 | |||
CHEMBL1672055 | 64652 | 6 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 616 | 4 | 0 | 3 | 6.7 | CC(=O)N1CCN([C@@H]2CCN(C(=O)N(C)[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@@H](c3ccc(F)cc3C)C2)CC1 | 10.1021/jm1013264 | |||
9873032 | 82157 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 579 | 5 | 0 | 5 | 6.2 | Cc1ccccc1-c1nc(N2CCN(C)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL203867 | 82157 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 579 | 5 | 0 | 5 | 6.2 | Cc1ccccc1-c1nc(N2CCN(C)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL3609615 | 218608 | 0 | None | -2 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00104a018 | |||
44380081 | 64882 | 0 | None | 100 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 738 | 13 | 1 | 7 | 6.3 | CN(C/C(=N\OCCN1CCNCC1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL167546 | 64882 | 0 | None | 100 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 738 | 13 | 1 | 7 | 6.3 | CN(C/C(=N\OCCN1CCNCC1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9810434 | 111160 | 0 | None | 1 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 713 | 12 | 1 | 6 | 6.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(C)(C)O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL310273 | 111160 | 0 | None | 1 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 713 | 12 | 1 | 6 | 6.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(C)(C)O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44407938 | 147224 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 446 | 5 | 1 | 2 | 5.4 | C[C@@H](OC[C@@]1(c2ccccc2)CN(C)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL380931 | 147224 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 446 | 5 | 1 | 2 | 5.4 | C[C@@H](OC[C@@]1(c2ccccc2)CN(C)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
52937467 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL1782141 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
52937467 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL1782141 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
52937467 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
CHEMBL1782141 | 69297 | 0 | None | -9 | 3 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
135416054 | 86999 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 514 | 8 | 3 | 5 | 5.5 | C[C@@H](OCC1(c2ccccc2)CC(NCc2n[nH]c(O)n2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL213735 | 86999 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 514 | 8 | 3 | 5 | 5.5 | C[C@@H](OCC1(c2ccccc2)CC(NCc2n[nH]c(O)n2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
10151946 | 87095 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.0 | CNC(=O)[C@]1(N)C[C@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL214194 | 87095 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.0 | CNC(=O)[C@]1(N)C[C@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
44560809 | 180279 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](N2CCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL453055 | 180279 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.2 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](N2CCCC2=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
44560833 | 183631 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 447 | 5 | 2 | 3 | 4.6 | C[C@@H](OC[C@@]1(c2ccccc2)CC(O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL461299 | 183631 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 447 | 5 | 2 | 3 | 4.6 | C[C@@H](OC[C@@]1(c2ccccc2)CC(O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
44241723 | 90307 | 0 | None | 12 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 674 | 6 | 0 | 5 | 6.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)[C@@H](C)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203704 | 90307 | 0 | None | 12 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 674 | 6 | 0 | 5 | 6.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)[C@@H](C)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
10698493 | 116556 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 581 | 9 | 3 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=N)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL323224 | 116556 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 581 | 9 | 3 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=N)NCc1ccccc1Cl | 10.1021/jm970499g | |||
10522676 | 125939 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 362 | 6 | 2 | 4 | 4.5 | COc1ccc(-c2ccco2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL342966 | 125939 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 362 | 6 | 2 | 4 | 4.5 | COc1ccc(-c2ccco2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
10761962 | 126004 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 374 | 6 | 2 | 5 | 2.7 | COc1ccc(S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL343404 | 126004 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 374 | 6 | 2 | 5 | 2.7 | COc1ccc(S(C)(=O)=O)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
24969353 | 205926 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 503 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)C1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL589371 | 205926 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 503 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)C1(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 | 10.1016/j.bmcl.2009.11.078 | |||
46224928 | 206181 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 515 | 2 | 1 | 2 | 6.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCC=CC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591074 | 206181 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 515 | 2 | 1 | 2 | 6.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCC=CC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
46889695 | 13701 | 0 | None | 2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2C[C@@H](O)C[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084436 | 13701 | 0 | None | 2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2C[C@@H](O)C[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
104974 | 10248 | 31 | None | -1 | 7 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/S0960-894X(01)80901-X | |||
2111 | 10248 | 31 | None | -1 | 7 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/S0960-894X(01)80901-X | |||
3481 | 10248 | 31 | None | -1 | 7 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/S0960-894X(01)80901-X | |||
CHEMBL308148 | 10248 | 31 | None | -1 | 7 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/S0960-894X(01)80901-X | |||
DB06660 | 10248 | 31 | None | -1 | 7 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 10.1016/S0960-894X(01)80901-X | |||
46227361 | 209362 | 0 | None | 14 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611925 | 209362 | 0 | None | 14 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
11261795 | 205481 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL492117 | 205481 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL581391 | 205481 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
52943348 | 25079 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.4 | CNC(=O)[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270665 | 25079 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 5.4 | CNC(=O)[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
10462 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2005.11.047 | |||
9808518 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206488 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1016/j.bmcl.2005.11.047 | |||
122187205 | 129781 | 0 | None | -1 | 4 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 981 | 22 | 8 | 9 | 5.3 | CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3608938 | 129781 | 0 | None | -1 | 4 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 981 | 22 | 8 | 9 | 5.3 | CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
10311496 | 25033 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 515 | 6 | 2 | 3 | 5.5 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](N2CCNC2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270370 | 25033 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 515 | 6 | 2 | 3 | 5.5 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](N2CCNC2=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
44380448 | 127058 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 670 | 12 | 1 | 6 | 6.4 | CN(C/C(=N\OCCO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL352588 | 127058 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 670 | 12 | 1 | 6 | 6.4 | CN(C/C(=N\OCCO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315483 | 103374 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 728 | 13 | 2 | 7 | 5.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN([C@H](CO)C(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL263243 | 103374 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 728 | 13 | 2 | 7 | 5.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN([C@H](CO)C(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
101195489 | 162399 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 713 | 12 | 3 | 7 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(=N)NO)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9875056 | 162399 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 713 | 12 | 3 | 7 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(=N)NO)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL404599 | 162399 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 713 | 12 | 3 | 7 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(=N)NO)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9853636 | 212229 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 762 | 14 | 1 | 7 | 5.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CCNS(C)(=O)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL80355 | 212229 | 0 | None | -1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 762 | 14 | 1 | 7 | 5.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CCNS(C)(=O)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
10296442 | 82281 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204306 | 82281 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
24768355 | 175674 | 0 | None | 15 | 5 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL438389 | 175674 | 0 | None | 15 | 5 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
10296442 | 82281 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL204306 | 82281 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
44560773 | 179748 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 4.1 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](NS(C)(=O)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL451763 | 179748 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 4.1 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@H](NS(C)(=O)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
10194796 | 198634 | 0 | None | 6309 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)CCC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL519914 | 198634 | 0 | None | 6309 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 431 | 5 | 1 | 2 | 5.6 | C[C@@H](OC[C@@]1(c2ccccc2)CCC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL439019 | 220597 | 0 | None | 3 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
52940879 | 25100 | 0 | None | 489 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 563 | 6 | 2 | 3 | 4.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)NCCO)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL1270786 | 25100 | 0 | None | 489 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 563 | 6 | 2 | 3 | 4.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)NCCO)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
44307773 | 109137 | 0 | None | 17 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 779 | 13 | 0 | 7 | 7.6 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)C3CCN(C)CC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL303803 | 109137 | 0 | None | 17 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 779 | 13 | 0 | 7 | 7.6 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)C3CCN(C)CC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44307757 | 210315 | 0 | None | 1 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL66441 | 210315 | 0 | None | 1 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
46889696 | 13702 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2C[C@H](O)C[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084437 | 13702 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2C[C@H](O)C[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
24768355 | 175674 | 0 | None | 15 | 5 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
CHEMBL438389 | 175674 | 0 | None | 15 | 5 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
71458106 | 86374 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 348 | 5 | 2 | 3 | 4.0 | COc1ccccc1CN[C@H]1C2CCNC1(c1ccccc1)CC=C2C | 10.1016/0960-894X(95)00552-5 | |||
CHEMBL2114439 | 86374 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 348 | 5 | 2 | 3 | 4.0 | COc1ccccc1CN[C@H]1C2CCNC1(c1ccccc1)CC=C2C | 10.1016/0960-894X(95)00552-5 | |||
51003117 | 64647 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672049 | 64647 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 545 | 4 | 0 | 2 | 7.2 | Cc1cc(F)ccc1[C@H]1C[C@H](N2CCC2)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
10311306 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | nan | |||
5027 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | nan | |||
5749 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | nan | |||
CHEMBL3707331 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | nan | |||
DB09291 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | nan | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
10128131 | 25022 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270272 | 25022 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.1 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NC(N)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
44380337 | 64209 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 735 | 14 | 0 | 8 | 7.1 | CN(C/C(=N\OCCCn1cncn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL165465 | 64209 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 735 | 14 | 0 | 8 | 7.1 | CN(C/C(=N\OCCCn1cncn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380396 | 64494 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166921 | 64494 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 698 | 12 | 3 | 7 | 6.4 | CN(C/C(=N\OCC(=N)NO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380082 | 64889 | 0 | None | 12 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 683 | 13 | 1 | 6 | 6.7 | CN(C/C(=N\OCCCN)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL167606 | 64889 | 0 | None | 12 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 683 | 13 | 1 | 6 | 6.7 | CN(C/C(=N\OCCCN)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380091 | 127499 | 0 | None | 2 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 684 | 13 | 1 | 6 | 6.8 | CN(C/C(=N\OCCCO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354772 | 127499 | 0 | None | 2 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 684 | 13 | 1 | 6 | 6.8 | CN(C/C(=N\OCCCO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380473 | 127562 | 0 | None | 549 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 684 | 12 | 1 | 6 | 6.5 | CN(C/C(=N\OCC(=O)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL355429 | 127562 | 0 | None | 549 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 684 | 12 | 1 | 6 | 6.5 | CN(C/C(=N\OCC(=O)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9896757 | 211760 | 0 | None | 1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 732 | 12 | 0 | 6 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccccn3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76580 | 211760 | 0 | None | 1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 732 | 12 | 0 | 6 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccccn3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44241710 | 90306 | 1 | None | 3 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203703 | 90306 | 1 | None | 3 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44314480 | 109716 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL306311 | 109716 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
10127439 | 179877 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 5.9 | C[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452022 | 179877 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 5.9 | C[C@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
44241710 | 90306 | 1 | None | 3 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203703 | 90306 | 1 | None | 3 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
71452185 | 90310 | 0 | None | -2 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203707 | 90310 | 0 | None | -2 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
10817360 | 11965 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL106078 | 11965 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
10769059 | 115394 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(F)c1 | 10.1021/jm970499g | |||
CHEMBL320581 | 115394 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(F)c1 | 10.1021/jm970499g | |||
44307898 | 208252 | 0 | None | -1 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL60504 | 208252 | 0 | None | -1 | 2 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL387670 | 219190 | 0 | None | 109 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061369n | |||||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm100157m | |||
10128485 | 155366 | 11 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 515 | 5 | 3 | 4 | 4.7 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CN1)NC(=O)NC2=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
CHEMBL3939059 | 155366 | 11 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 515 | 5 | 3 | 4 | 4.7 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@]2(CN1)NC(=O)NC2=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | nan | |||
11296094 | 13203 | 0 | None | 3 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 573 | 7 | 1 | 4 | 6.8 | CN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1082415 | 13203 | 0 | None | 3 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 573 | 7 | 1 | 4 | 6.8 | CN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00481-8 | |||
10621261 | 43304 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 404 | 6 | 2 | 5 | 4.3 | COc1ccc(-c2c(C)nn(C)c2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL144793 | 43304 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 404 | 6 | 2 | 5 | 4.3 | COc1ccc(-c2c(C)nn(C)c2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
9929728 | 46536 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 379 | 6 | 2 | 5 | 4.4 | COc1ccc(-c2nccs2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL147619 | 46536 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 379 | 6 | 2 | 5 | 4.4 | COc1ccc(-c2nccs2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
44408039 | 82277 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 569 | 8 | 2 | 5 | 4.9 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204297 | 82277 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 569 | 8 | 2 | 5 | 4.9 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN | 10.1016/j.bmcl.2005.10.077 | |||
44408047 | 103543 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 597 | 9 | 1 | 5 | 5.5 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN(C)C | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL264660 | 103543 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 597 | 9 | 1 | 5 | 5.5 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN(C)C | 10.1016/j.bmcl.2005.10.077 | |||
46224962 | 206183 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 518 | 2 | 2 | 3 | 5.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCNC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591076 | 206183 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 518 | 2 | 2 | 3 | 5.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCNC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
10476340 | 101784 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 404 | 6 | 2 | 5 | 4.5 | COc1ccc(C2(C(F)(F)F)N=N2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
CHEMBL25492 | 101784 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 404 | 6 | 2 | 5 | 4.5 | COc1ccc(C2(C(F)(F)F)N=N2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(95)00207-A | |||
44380206 | 64546 | 0 | None | 1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 658 | 11 | 0 | 5 | 7.3 | CN(C/C(=N\OCF)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166961 | 64546 | 0 | None | 1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 658 | 11 | 0 | 5 | 7.3 | CN(C/C(=N\OCF)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380132 | 103202 | 0 | None | 4 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 730 | 14 | 0 | 6 | 7.2 | CN(C/C(=N\OCCC[S+](C)[O-])C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL262053 | 103202 | 0 | None | 4 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 730 | 14 | 0 | 6 | 7.2 | CN(C/C(=N\OCCC[S+](C)[O-])C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380290 | 106866 | 0 | None | 21 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 736 | 14 | 0 | 9 | 6.5 | CN(C/C(=N\OCCCn1cnnn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL287369 | 106866 | 0 | None | 21 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 736 | 14 | 0 | 9 | 6.5 | CN(C/C(=N\OCCCn1cnnn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9961955 | 179552 | 0 | None | -1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 726 | 11 | 0 | 7 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL451235 | 179552 | 0 | None | -1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 726 | 11 | 0 | 7 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9810544 | 211571 | 0 | None | -2 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 726 | 12 | 1 | 6 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C(C)(C)C(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL74956 | 211571 | 0 | None | -2 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 726 | 12 | 1 | 6 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C(C)(C)C(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44408107 | 82069 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 478 | 6 | 1 | 2 | 5.9 | CCN1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL203740 | 82069 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 478 | 6 | 1 | 2 | 5.9 | CCN1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL389651 | 219208 | 0 | None | 6 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
10817013 | 16028 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(N)=O | 10.1021/jm970499g | |||
CHEMBL110770 | 16028 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(N)=O | 10.1021/jm970499g | |||
44307821 | 108891 | 0 | None | 4 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL302329 | 108891 | 0 | None | 4 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44307819 | 109373 | 0 | None | 1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL304106 | 109373 | 0 | None | 1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44307677 | 176043 | 0 | None | -1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL441252 | 176043 | 0 | None | -1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44307820 | 210414 | 0 | None | -1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL67171 | 210414 | 0 | None | -1 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
11734825 | 19999 | 0 | None | 549 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
CHEMBL119126 | 19999 | 0 | None | 549 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
122187725 | 129845 | 0 | None | 2 | 4 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 691 | 11 | 6 | 5 | 4.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3609621 | 129845 | 0 | None | 2 | 4 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 691 | 11 | 6 | 5 | 4.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
46889690 | 13723 | 0 | None | 9 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 585 | 5 | 1 | 4 | 7.0 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@H](O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084522 | 13723 | 0 | None | 9 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 585 | 5 | 1 | 4 | 7.0 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@H](O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL2371977 | 216950 | 0 | None | 17 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
CHEMBL2419540 | 217220 | 0 | None | 4 | 4 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
10530375 | 12401 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL107763 | 12401 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 534 | 8 | 2 | 3 | 5.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 | 10.1021/jm970499g | |||
44380131 | 64387 | 0 | None | 3 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 746 | 14 | 0 | 7 | 6.8 | CN(C/C(=N\OCCCS(C)(=O)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166828 | 64387 | 0 | None | 3 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 746 | 14 | 0 | 7 | 6.8 | CN(C/C(=N\OCCCS(C)(=O)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380415 | 127093 | 0 | None | 2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 683 | 12 | 1 | 6 | 5.9 | CN(C/C(=N\OCC(N)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL352813 | 127093 | 0 | None | 2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 683 | 12 | 1 | 6 | 5.9 | CN(C/C(=N\OCC(N)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9831674 | 111188 | 0 | None | 1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 712 | 12 | 1 | 6 | 5.9 | CNC(=O)CN1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL310334 | 111188 | 0 | None | 1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 712 | 12 | 1 | 6 | 5.9 | CNC(=O)CN1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00462-6 | |||
9917970 | 211732 | 0 | None | -1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 683 | 11 | 0 | 5 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76437 | 211732 | 0 | None | -1 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 683 | 11 | 0 | 5 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(C(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44337201 | 115389 | 0 | None | 7 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL320548 | 115389 | 0 | None | 7 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44299271 | 202827 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL56038 | 202827 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 510 | 10 | 2 | 3 | 5.5 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(00)00463-7 | |||
10231172 | 146043 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 519 | 6 | 2 | 3 | 5.1 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1C1CCNCC1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL379038 | 146043 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 519 | 6 | 2 | 3 | 5.1 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1C1CCNCC1 | 10.1016/j.bmcl.2005.10.072 | |||
44560755 | 179979 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 4.7 | CC(=O)N[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452271 | 179979 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 488 | 6 | 2 | 3 | 4.7 | CC(=O)N[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
52946919 | 25099 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 476 | 4 | 1 | 2 | 5.4 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CNC[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL1270785 | 25099 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 476 | 4 | 1 | 2 | 5.4 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CNC[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
46889697 | 13703 | 0 | None | 32 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 643 | 8 | 0 | 5 | 7.6 | COC[C@@H]1C[C@@H](OC)CN1c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084438 | 13703 | 0 | None | 32 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 643 | 8 | 0 | 5 | 7.6 | COC[C@@H]1C[C@@H](OC)CN1c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
51003055 | 64644 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 533 | 4 | 0 | 2 | 7.1 | Cc1cc(F)ccc1[C@H]1C[C@H](N(C)C)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
CHEMBL1672046 | 64644 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 533 | 4 | 0 | 2 | 7.1 | Cc1cc(F)ccc1[C@H]1C[C@H](N(C)C)CCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1013264 | |||
4898 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmcl.2005.11.047 | |||
5742 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmcl.2005.11.047 | |||
6451149 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206253 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmcl.2005.11.047 | |||
DB09048 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 10.1016/j.bmcl.2005.11.047 | |||
54581461 | 68037 | 0 | None | -6 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
CHEMBL1766207 | 68037 | 0 | None | -6 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
127032533 | 145565 | 0 | None | 10 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1108 | 22 | 9 | 10 | 4.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCN([C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)CC1 | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780776 | 145565 | 0 | None | 10 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1108 | 22 | 9 | 10 | 4.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCN([C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)CC1 | 10.1021/acsmedchemlett.5b00359 | |||
71716116 | 93136 | 0 | None | 537 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 516 | 7 | 0 | 6 | 5.7 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)OCC)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1021/jm301653f | |||
CHEMBL2313630 | 93136 | 0 | None | 537 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 516 | 7 | 0 | 6 | 5.7 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)OCC)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1021/jm301653f | |||
44380062 | 127542 | 0 | None | 1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 740 | 14 | 2 | 6 | 6.7 | CNC(=O)NCCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL355295 | 127542 | 0 | None | 1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 740 | 14 | 2 | 6 | 6.7 | CNC(=O)NCCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9961936 | 109866 | 0 | None | -1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 723 | 12 | 1 | 8 | 5.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3nn[nH]n3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL307498 | 109866 | 0 | None | -1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 723 | 12 | 1 | 8 | 5.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3nn[nH]n3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44315370 | 211618 | 0 | None | 1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 789 | 14 | 0 | 7 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(=O)OCc3ccccc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL75479 | 211618 | 0 | None | 1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 789 | 14 | 0 | 7 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(CC(=O)OCc3ccccc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9831075 | 211932 | 0 | None | -1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 657 | 10 | 1 | 6 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL78132 | 211932 | 0 | None | -1 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 657 | 10 | 1 | 6 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
5759 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 10.1016/j.bmcl.2005.11.047 | |||
6450815 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL204694 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 10.1016/j.bmcl.2005.11.047 | |||
44338517 | 13107 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL108200 | 13107 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358516 | 175354 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 446 | 6 | 1 | 3 | 5.2 | Cc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL435796 | 175354 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 446 | 6 | 1 | 3 | 5.2 | Cc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
44346206 | 120438 | 3 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL332284 | 120438 | 3 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 417 | 5 | 1 | 2 | 5.9 | FC(F)(F)c1cc(COCC2(c3ccccc3)CCCCN2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
145948847 | 174259 | 0 | None | -1 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1123 | 22 | 9 | 9 | 5.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299423 | 174259 | 0 | None | -1 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1123 | 22 | 9 | 9 | 5.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
10173890 | 85004 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 460 | 6 | 2 | 3 | 4.7 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(N)=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL210591 | 85004 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 460 | 6 | 2 | 3 | 4.7 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(N)=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
10151946 | 87140 | 0 | None | 1995 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.0 | CNC(=O)[C@]1(N)C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL214388 | 87140 | 0 | None | 1995 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.0 | CNC(=O)[C@]1(N)C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)C1 | 10.1016/j.bmcl.2006.04.031 | |||
46889693 | 13724 | 0 | None | -1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 6 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCC[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084523 | 13724 | 0 | None | -1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 6 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCC[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44177670 | 68036 | 0 | None | -1 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766206 | 68036 | 0 | None | -1 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL426363 | 220124 | 0 | None | 26 | 3 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
11801327 | 16128 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 578 | 10 | 2 | 4 | 5.4 | COCc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL111295 | 16128 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 578 | 10 | 2 | 4 | 5.4 | COCc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
44307953 | 175973 | 0 | None | 35 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 784 | 12 | 1 | 7 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)[S+]3CCNCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL440679 | 175973 | 0 | None | 35 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 784 | 12 | 1 | 7 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)[S+]3CCNCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL540651 | 175973 | 0 | None | 35 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 784 | 12 | 1 | 7 | 6.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)[S+]3CCNCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
9875181 | 178122 | 0 | None | 7 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL446146 | 178122 | 0 | None | 7 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 725 | 12 | 0 | 6 | 6.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N(C)C)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
9810835 | 210354 | 0 | None | 7 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL66763 | 210354 | 0 | None | 7 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 767 | 12 | 0 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
9874206 | 210550 | 0 | None | 1 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL68060 | 210550 | 0 | None | 1 | 2 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
10762277 | 20253 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 379 | 6 | 3 | 8 | 1.8 | COc1ccc(-n2nnnc2N)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1193282 | 20253 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 379 | 6 | 3 | 8 | 1.8 | COc1ccc(-n2nnnc2N)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL544660 | 20253 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 379 | 6 | 3 | 8 | 1.8 | COc1ccc(-n2nnnc2N)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/0960-894X(96)00163-1 | |||
44281977 | 116171 | 0 | None | 1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 595 | 10 | 1 | 5 | 6.8 | CO/N=C(\CN(C)C(=O)c1cc(C)cc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32197 | 116171 | 0 | None | 1 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 595 | 10 | 1 | 5 | 6.8 | CO/N=C(\CN(C)C(=O)c1cc(C)cc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
52949509 | 25034 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NS(C)(=O)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270371 | 25034 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 5.0 | C[C@@H](OC[C@@]1(c2ccccc2)CC[C@H](NS(C)(=O)=O)CN1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2010.08.059 | |||
2098 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00391a046 | |||||
36511 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00391a046 | |||||
3805 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00391a046 | |||||
3835 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00391a046 | |||||
CHEMBL235363 | 10466 | 36 | None | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00391a046 | |||||
44315298 | 109888 | 0 | None | 1 | 3 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 721 | 12 | 0 | 6 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccoc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL307733 | 109888 | 0 | None | 1 | 3 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 721 | 12 | 0 | 6 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccoc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL2372071 | 216957 | 12 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(N)=O | 10.1016/s0960-894x(98)00219-4 | |||||
9808347 | 147540 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 579 | 5 | 0 | 5 | 6.2 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)nc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL381832 | 147540 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 579 | 5 | 0 | 5 | 6.2 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)nc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
127030411 | 145570 | 0 | None | 48 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1053 | 22 | 9 | 9 | 5.2 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@@H]1c1ccccc1 | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780820 | 145570 | 0 | None | 48 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1053 | 22 | 9 | 9 | 5.2 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@@H]1c1ccccc1 | 10.1021/acsmedchemlett.5b00359 | |||
52946726 | 24931 | 0 | None | 173 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 607 | 8 | 2 | 4 | 4.5 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)N(CCO)CCO)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL1269638 | 24931 | 0 | None | 173 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 607 | 8 | 2 | 4 | 4.5 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)N(CCO)CCO)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL2419537 | 217217 | 0 | None | -32 | 4 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
44241710 | 90306 | 1 | None | 3 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203703 | 90306 | 1 | None | 3 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 6.1 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
10650495 | 114196 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C#N | 10.1021/jm970499g | |||
CHEMBL318085 | 114196 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C#N | 10.1021/jm970499g | |||
10626666 | 115972 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(C#N)cc1 | 10.1021/jm970499g | |||
CHEMBL321554 | 115972 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(C#N)cc1 | 10.1021/jm970499g | |||
44307741 | 210566 | 0 | None | 15 | 2 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL68234 | 210566 | 0 | None | 15 | 2 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
10303099 | 14049 | 0 | None | 9 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 7 | 2 | 4 | 6.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(NCCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1086003 | 14049 | 0 | None | 9 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 559 | 7 | 2 | 4 | 6.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(NCCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
52940877 | 25094 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.8 | CCNC(=O)[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
CHEMBL1270767 | 25094 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 502 | 7 | 2 | 3 | 5.8 | CCNC(=O)[C@@H]1CC[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1 | 10.1016/j.bmcl.2010.08.059 | |||
44216236 | 13279 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 603 | 9 | 2 | 5 | 6.2 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N(CCO)CCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1082737 | 13279 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 603 | 9 | 2 | 5 | 6.2 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N(CCO)CCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44380279 | 64593 | 0 | None | 3 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 761 | 15 | 1 | 7 | 6.3 | CN(C/C(=N\OCCCNS(C)(=O)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166975 | 64593 | 0 | None | 3 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 761 | 15 | 1 | 7 | 6.3 | CN(C/C(=N\OCCCNS(C)(=O)=O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380414 | 64929 | 0 | None | 3 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 699 | 12 | 2 | 7 | 5.9 | CN(C/C(=N\OCC(=O)NO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL167994 | 64929 | 0 | None | 3 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 699 | 12 | 2 | 7 | 5.9 | CN(C/C(=N\OCC(=O)NO)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315421 | 112505 | 0 | None | 2 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 765 | 14 | 1 | 8 | 7.4 | CO/N=C(\CN(CCF)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL312612 | 112505 | 0 | None | 2 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 765 | 14 | 1 | 8 | 7.4 | CO/N=C(\CN(CCF)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
15508105 | 211610 | 0 | None | -1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 675 | 10 | 1 | 7 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL75422 | 211610 | 0 | None | -1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 675 | 10 | 1 | 7 | 7.9 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
127033167 | 145531 | 0 | None | 33 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1067 | 23 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780408 | 145531 | 0 | None | 33 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1067 | 23 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
9874206 | 210550 | 0 | None | 1 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL68060 | 210550 | 0 | None | 1 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
9874473 | 48582 | 0 | None | 16 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
CHEMBL149326 | 48582 | 0 | None | 16 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
44407998 | 82273 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204262 | 82273 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44408046 | 147522 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381814 | 147522 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 667 | 11 | 1 | 6 | 6.1 | C/C(CCCN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44407971 | 147532 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 625 | 9 | 1 | 6 | 4.9 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381822 | 147532 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 625 | 9 | 1 | 6 | 4.9 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C=N\OCCN2CCOCC2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44358335 | 33636 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.2 | C[C@H](OC[C@H](c1ccccc1)N1CCN(CC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136347 | 33636 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.2 | C[C@H](OC[C@H](c1ccccc1)N1CCN(CC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
10437488 | 36699 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.3 | C[C@H](OC[C@H](c1ccccc1)N1CCN(CCOCC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138824 | 36699 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.3 | C[C@H](OC[C@H](c1ccccc1)N1CCN(CCOCC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
20599018 | 206182 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 517 | 2 | 1 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591075 | 206182 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 517 | 2 | 1 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
9826304 | 193794 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1C1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL490755 | 193794 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1C1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
2106 | 10319 | 4 | None | -5 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 10.1016/s0960-894x(02)00462-6 | |||
9875034 | 10319 | 4 | None | -5 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL77023 | 10319 | 4 | None | -5 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 10.1016/s0960-894x(02)00462-6 | |||
44315390 | 211821 | 0 | None | 1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 733 | 12 | 1 | 8 | 7.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL77042 | 211821 | 0 | None | 1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 733 | 12 | 1 | 8 | 7.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44315576 | 212024 | 0 | None | 1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 747 | 12 | 0 | 9 | 7.2 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)OC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL78851 | 212024 | 0 | None | 1 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 747 | 12 | 0 | 9 | 7.2 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(CC(=O)OC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
10304406 | 147118 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 613 | 5 | 0 | 5 | 6.3 | Cc1ccccc1-c1cc(N2CCS(=O)(=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL380705 | 147118 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 613 | 5 | 0 | 5 | 6.3 | Cc1ccccc1-c1cc(N2CCS(=O)(=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
155551678 | 182211 | 0 | None | -4 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.9 | CNC(=O)C[C@H]1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1021/acs.jmedchem.9b00017 | |||
CHEMBL4576324 | 182211 | 0 | None | -4 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.9 | CNC(=O)C[C@H]1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1021/acs.jmedchem.9b00017 | |||
10218122 | 145161 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 6.2 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N2CCCCC2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL377242 | 145161 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 528 | 6 | 1 | 3 | 6.2 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N2CCCCC2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
10239346 | 145521 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.9 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N2CCCC2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL378027 | 145521 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 514 | 6 | 1 | 3 | 5.9 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N2CCCC2)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
71452185 | 90310 | 0 | None | -2 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203707 | 90310 | 0 | None | -2 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 690 | 7 | 1 | 6 | 5.6 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
71453994 | 90309 | 0 | None | 10 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 583 | 5 | 1 | 4 | 6.7 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203706 | 90309 | 0 | None | 10 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 583 | 5 | 1 | 4 | 6.7 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44307679 | 210296 | 0 | None | -1 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL66332 | 210296 | 0 | None | -1 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
46889667 | 13645 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 10 | 2 | 5 | 6.6 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N(CCO)CCCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084165 | 13645 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 10 | 2 | 5 | 6.6 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N(CCO)CCCO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
9872249 | 83325 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 549 | 5 | 0 | 3 | 6.7 | Cc1ccccc1-c1cc(N2CCN(C)CC2)ccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206171 | 83325 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 549 | 5 | 0 | 3 | 6.7 | Cc1ccccc1-c1cc(N2CCN(C)CC2)ccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
127031644 | 145612 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1007 | 16 | 7 | 8 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3781336 | 145612 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1007 | 16 | 7 | 8 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
127033173 | 145622 | 0 | None | -2 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1062 | 16 | 7 | 9 | 5.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CCN([C@@H]3CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C[C@@H]3c3ccccc3)CC2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3781519 | 145622 | 0 | None | -2 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1062 | 16 | 7 | 9 | 5.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CCN([C@@H]3CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C[C@@H]3c3ccccc3)CC2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
145948797 | 174255 | 0 | None | -1 | 4 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1105 | 22 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299390 | 174255 | 0 | None | -1 | 4 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1105 | 22 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
24768356 | 162641 | 0 | None | 4 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
CHEMBL406030 | 162641 | 0 | None | 4 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
52943089 | 24932 | 0 | None | 263 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 630 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCN(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](N(C)C(=O)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL1269639 | 24932 | 0 | None | 263 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 630 | 4 | 0 | 3 | 5.4 | CC(=O)N1CCN(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](N(C)C(=O)C(C)(C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 | 10.1016/j.bmcl.2010.08.138 | |||
11490769 | 90311 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 660 | 6 | 0 | 5 | 6.3 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203708 | 90311 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 660 | 6 | 0 | 5 | 6.3 | Cc1cc(F)ccc1-c1cc(N2CCN(S(C)(=O)=O)CC2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
71457524 | 90308 | 0 | None | -5 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203705 | 90308 | 0 | None | -5 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
71455736 | 90312 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 687 | 5 | 0 | 6 | 6.9 | Cc1cc(F)ccc1-c1cc(N2CCC3(CC2)OCCS3(=O)=O)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203709 | 90312 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 687 | 5 | 0 | 6 | 6.9 | Cc1cc(F)ccc1-c1cc(N2CCC3(CC2)OCCS3(=O)=O)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44380526 | 65102 | 0 | None | -1 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 665 | 11 | 0 | 6 | 6.9 | CN(C/C(=N\OCC#N)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168272 | 65102 | 0 | None | -1 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 665 | 11 | 0 | 6 | 6.9 | CN(C/C(=N\OCC#N)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315369 | 109796 | 0 | None | 1 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 689 | 10 | 0 | 7 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(C)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL306952 | 109796 | 0 | None | 1 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 689 | 10 | 0 | 7 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(=O)n(C)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44305818 | 21567 | 0 | None | 1 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL1206764 | 21567 | 0 | None | 1 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL305119 | 21567 | 0 | None | 1 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
85169 | 13687 | 10 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL108438 | 13687 | 10 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
85169 | 13687 | 10 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL108438 | 13687 | 10 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
10204249 | 82339 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 450 | 5 | 2 | 2 | 5.1 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204554 | 82339 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 450 | 5 | 2 | 2 | 5.1 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
85169 | 13687 | 10 | None | -2 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL108438 | 13687 | 10 | None | -2 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
85169 | 13687 | 10 | None | -2 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
CHEMBL108438 | 13687 | 10 | None | -2 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
44233410 | 202373 | 0 | None | 38 | 3 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 1327 | 28 | 14 | 16 | 1.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL555504 | 202373 | 0 | None | 38 | 3 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 1327 | 28 | 14 | 16 | 1.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80386-3 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80386-3 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)80386-3 | |||
44307678 | 205454 | 0 | None | 1 | 2 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL57993 | 205454 | 0 | None | 1 | 2 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CC[C@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
46889694 | 13348 | 0 | None | 4 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 599 | 6 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCC[C@@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1083052 | 13348 | 0 | None | 4 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 599 | 6 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCC[C@@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
46889698 | 13704 | 0 | None | -1 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@H](O)[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084439 | 13704 | 0 | None | -1 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 615 | 6 | 2 | 5 | 6.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@H](O)[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44407902 | 82199 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 652 | 9 | 1 | 6 | 5.2 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCN(C)CC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204114 | 82199 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 652 | 9 | 1 | 6 | 5.2 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCN(C)CC1 | 10.1016/j.bmcl.2005.10.077 | |||
44338518 | 14494 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2ccccc2Cl)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL108889 | 14494 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2ccccc2Cl)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
22353151 | 15903 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL109937 | 15903 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358612 | 37975 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 446 | 6 | 0 | 3 | 5.2 | CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL140080 | 37975 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 446 | 6 | 0 | 3 | 5.2 | CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358249 | 123328 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 484 | 8 | 1 | 3 | 6.2 | C=Cc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1C=C | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL336305 | 123328 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 484 | 8 | 1 | 3 | 6.2 | C=Cc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1C=C | 10.1016/s0960-894x(02)00956-3 | |||
44338359 | 170208 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2cccc(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL419742 | 170208 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 6 | 1 | 3 | 5.5 | FC(F)(F)c1cc(COCC(c2cccc(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44380338 | 127254 | 0 | None | 4 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 734 | 14 | 0 | 7 | 7.7 | CN(C/C(=N\OCCCn1ccnc1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354196 | 127254 | 0 | None | 4 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 734 | 14 | 0 | 7 | 7.7 | CN(C/C(=N\OCCCn1ccnc1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315297 | 211646 | 0 | None | -1 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 833 | 15 | 1 | 8 | 8.0 | CCOC(=O)[C@@H](Cc1ccc(O)cc1)N1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL75698 | 211646 | 0 | None | -1 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 833 | 15 | 1 | 8 | 8.0 | CCOC(=O)[C@@H](Cc1ccc(O)cc1)N1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL589979 | 222580 | 11 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm400209h | |||||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
22960739 | 82385 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 533 | 8 | 1 | 3 | 5.4 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1CCN1CCCC1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204714 | 82385 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 533 | 8 | 1 | 3 | 5.4 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1CCN1CCCC1 | 10.1016/j.bmcl.2005.10.072 | |||
44177770 | 129780 | 0 | None | -31 | 4 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 939 | 20 | 8 | 9 | 4.1 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3608937 | 129780 | 0 | None | -31 | 4 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 939 | 20 | 8 | 9 | 4.1 | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL589979 | 222580 | 11 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
CHEMBL589979 | 222580 | 11 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2018.06.009 | |||||
24768354 | 104742 | 0 | None | 28 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 955 | 22 | 8 | 9 | 3.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccccc1 | 10.1021/jm070332f | |||
CHEMBL272665 | 104742 | 0 | None | 28 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 955 | 22 | 8 | 9 | 3.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccccc1 | 10.1021/jm070332f | |||
CHEMBL2419543 | 217223 | 0 | None | -16 | 4 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
CHEMBL261390 | 217297 | 0 | None | -34 | 3 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||||
71461646 | 85684 | 0 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 676 | 11 | 0 | 5 | 7.6 | CN(C/C(=N\OC(F)F)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL2112941 | 85684 | 0 | None | 2 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 676 | 11 | 0 | 5 | 7.6 | CN(C/C(=N\OC(F)F)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380289 | 127033 | 0 | None | 14 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 734 | 14 | 0 | 7 | 7.7 | CN(C/C(=N\OCCCn1cccn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL352364 | 127033 | 0 | None | 14 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 734 | 14 | 0 | 7 | 7.7 | CN(C/C(=N\OCCCn1cccn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44407939 | 82133 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 460 | 6 | 1 | 2 | 5.7 | CCN1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL203753 | 82133 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 460 | 6 | 1 | 2 | 5.7 | CCN1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
9850565 | 82969 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 551 | 5 | 0 | 5 | 5.5 | Cc1ccccc1-c1nc(N2CCN(C)CC2)ncc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL205829 | 82969 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 551 | 5 | 0 | 5 | 5.5 | Cc1ccccc1-c1nc(N2CCN(C)CC2)ncc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44408838 | 148044 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)cc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL383125 | 148044 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)cc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
71455736 | 90312 | 0 | None | 6 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 687 | 5 | 0 | 6 | 6.9 | Cc1cc(F)ccc1-c1cc(N2CCC3(CC2)OCCS3(=O)=O)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203709 | 90312 | 0 | None | 6 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 687 | 5 | 0 | 6 | 6.9 | Cc1cc(F)ccc1-c1cc(N2CCC3(CC2)OCCS3(=O)=O)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
10745532 | 16003 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 564 | 9 | 3 | 4 | 4.7 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1CO | 10.1021/jm970499g | |||
CHEMBL110656 | 16003 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 564 | 9 | 3 | 4 | 4.7 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1CO | 10.1021/jm970499g | |||
10555763 | 114819 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 612 | 9 | 1 | 3 | 6.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)N(C)C(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL319476 | 114819 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 612 | 9 | 1 | 3 | 6.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)N(C)C(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
9874473 | 48582 | 0 | None | 16 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
CHEMBL149326 | 48582 | 0 | None | 16 | 3 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
46889668 | 13347 | 0 | None | 8 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 599 | 5 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC(O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1083051 | 13347 | 0 | None | 8 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 599 | 5 | 1 | 4 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC(O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44380080 | 19014 | 0 | None | 323 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 726 | 14 | 0 | 5 | 7.5 | CN(C/C(=N\OCCC[N+](C)(C)C)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL1184507 | 19014 | 0 | None | 323 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 726 | 14 | 0 | 5 | 7.5 | CN(C/C(=N\OCCC[N+](C)(C)C)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL352842 | 19014 | 0 | None | 323 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 726 | 14 | 0 | 5 | 7.5 | CN(C/C(=N\OCCC[N+](C)(C)C)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10145229 | 15945 | 0 | None | 2 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL110219 | 15945 | 0 | None | 2 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44337370 | 114193 | 0 | None | 147 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)[C@@H](c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL318081 | 114193 | 0 | None | 147 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)[C@@H](c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
101658885 | 168267 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 899 | 27 | 12 | 12 | -3.5 | N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)O | 10.1016/j.bmcl.2018.06.009 | |||
CHEMBL4127872 | 168267 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 899 | 27 | 12 | 12 | -3.5 | N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)O | 10.1016/j.bmcl.2018.06.009 | |||
44233184 | 201547 | 0 | None | 12 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL538131 | 201547 | 0 | None | 12 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
44380092 | 127139 | 0 | None | 12 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 698 | 12 | 1 | 6 | 7.2 | CN(C/C(=N\OCC(C)(C)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL353162 | 127139 | 0 | None | 12 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 698 | 12 | 1 | 6 | 7.2 | CN(C/C(=N\OCC(C)(C)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315589 | 211617 | 0 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 804 | 16 | 1 | 9 | 7.2 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)NCCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL75478 | 211617 | 0 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 804 | 16 | 1 | 9 | 7.2 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)NCCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9831707 | 211806 | 0 | None | -3 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 718 | 11 | 0 | 6 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(c3ccccn3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76965 | 211806 | 0 | None | -3 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 718 | 11 | 0 | 6 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(c3ccccn3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
127033168 | 145552 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1021 | 17 | 7 | 8 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780686 | 145552 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1021 | 17 | 7 | 8 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
44315589 | 211617 | 0 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 804 | 16 | 1 | 9 | 7.2 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)NCCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/acs.jmedchem.9b00017 | |||
CHEMBL75478 | 211617 | 0 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 804 | 16 | 1 | 9 | 7.2 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)NCCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/acs.jmedchem.9b00017 | |||
49863734 | 22105 | 0 | None | 13 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
CHEMBL1214027 | 22105 | 0 | None | 13 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
11793946 | 45002 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 376 | 6 | 2 | 5 | 3.7 | COc1ccc(-c2nccn2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL146210 | 45002 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 376 | 6 | 2 | 5 | 3.7 | COc1ccc(-c2nccn2C)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
44408045 | 82381 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 583 | 9 | 2 | 5 | 5.2 | CNCCO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204691 | 82381 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 583 | 9 | 2 | 5 | 5.2 | CNCCO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
44358318 | 37019 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139088 | 37019 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
22353158 | 37656 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 8 | 1 | 4 | 4.6 | OCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139750 | 37656 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 8 | 1 | 4 | 4.6 | OCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358456 | 125671 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 523 | 8 | 0 | 4 | 6.2 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(Cc3ccccn3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL342266 | 125671 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 523 | 8 | 0 | 4 | 6.2 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(Cc3ccccn3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
10741553 | 20268 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 435 | 9 | 2 | 8 | 3.1 | CCN(CC)c1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL1193479 | 20268 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 435 | 9 | 2 | 8 | 3.1 | CCN(CC)c1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
CHEMBL544892 | 20268 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 435 | 9 | 2 | 8 | 3.1 | CCN(CC)c1nnnn1-c1ccc(OC)c(CN[C@H]2CCCN[C@H]2c2ccccc2)c1 | 10.1016/0960-894X(96)00163-1 | |||
9892922 | 107680 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 3 | 1 | 2 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1021/jm1016285 | |||
CHEMBL293844 | 107680 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 3 | 1 | 2 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1021/jm1016285 | |||
44215305 | 126032 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 695 | 12 | 0 | 5 | 8.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL343627 | 126032 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 695 | 12 | 0 | 5 | 8.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44407907 | 82472 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL204764 | 82472 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44407917 | 103333 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 617 | 8 | 1 | 5 | 6.6 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCc1ccccn1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL262989 | 103333 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 617 | 8 | 1 | 5 | 6.6 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCc1ccccn1 | 10.1016/j.bmcl.2005.10.077 | |||
44408088 | 146603 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 639 | 9 | 1 | 6 | 5.3 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL379898 | 146603 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 639 | 9 | 1 | 6 | 5.3 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44358568 | 37468 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 489 | 8 | 1 | 4 | 4.1 | NC(=O)CN1CCN([C@@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139499 | 37468 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 489 | 8 | 1 | 4 | 4.1 | NC(=O)CN1CCN([C@@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
10302076 | 37506 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 532 | 11 | 1 | 4 | 5.9 | O=C(O)CCCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139531 | 37506 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 532 | 11 | 1 | 4 | 5.9 | O=C(O)CCCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
9892922 | 107680 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 3 | 1 | 2 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL293844 | 107680 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 3 | 1 | 2 | 6.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
44281685 | 106807 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 587 | 10 | 1 | 6 | 6.6 | CO/N=C(\CN(C)C(=O)c1ccc(C)s1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL286901 | 106807 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 587 | 10 | 1 | 6 | 6.6 | CO/N=C(\CN(C)C(=O)c1ccc(C)s1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281538 | 117090 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 696 | 11 | 1 | 5 | 8.2 | CO/N=C(\COCc1cc(Br)cc(Br)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32385 | 117090 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 696 | 11 | 1 | 5 | 8.2 | CO/N=C(\COCc1cc(Br)cc(Br)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
3082491 | 206096 | 20 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 277 | 7 | 3 | 3 | 0.6 | CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||
CHEMBL590518 | 206096 | 20 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 277 | 7 | 3 | 3 | 0.6 | CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||
CHEMBL58178 | 222558 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||||
CHEMBL591489 | 222581 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1 | 10.1021/jm901352b | |||||
44380277 | 66019 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 702 | 13 | 1 | 5 | 9.3 | C=CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL170325 | 66019 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 702 | 13 | 1 | 5 | 9.3 | C=CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
73212439 | 111384 | 0 | None | 10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 545 | 8 | 2 | 4 | 4.3 | CC(C)(C(=O)N[C@H](C(=O)NCCN1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104782 | 111384 | 0 | None | 10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 545 | 8 | 2 | 4 | 4.3 | CC(C)(C(=O)N[C@H](C(=O)NCCN1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
44338531 | 16130 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.4 | CC(C)(C)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL111304 | 16130 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.4 | CC(C)(C)c1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(C)(C)C)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358346 | 33559 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1ccc(COCC(c2ccccc2)N2CCNCC2)cc1Cl | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136279 | 33559 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1ccc(COCC(c2ccccc2)N2CCNCC2)cc1Cl | 10.1016/s0960-894x(02)00956-3 | |||
46224962 | 206183 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 518 | 2 | 2 | 3 | 5.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCNC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591076 | 206183 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 518 | 2 | 2 | 3 | 5.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCNC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL261608 | 217298 | 0 | None | -3 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm070332f | |||||
44281332 | 119687 | 0 | None | -100 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 588 | 11 | 1 | 8 | 6.4 | CO/N=C(\COCc1noc(C(C)(C)C)n1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33106 | 119687 | 0 | None | -100 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 588 | 11 | 1 | 8 | 6.4 | CO/N=C(\COCc1noc(C(C)(C)C)n1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44304397 | 210065 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 473 | 2 | 0 | 2 | 5.3 | CC1c2ccccc2N(C)C(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL64698 | 210065 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 473 | 2 | 0 | 2 | 5.3 | CC1c2ccccc2N(C)C(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
44304302 | 210101 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 385 | 3 | 1 | 2 | 4.3 | CN(Cc1ccccc1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL64862 | 210101 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 385 | 3 | 1 | 2 | 4.3 | CN(Cc1ccccc1)C(=O)N1CC(=O)Nc2ccccc2C1c1ccccc1 | 10.1016/S0960-894X(97)00353-3 | |||
45379600 | 205956 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 355 | 8 | 3 | 4 | 1.1 | COc1ccc(C[C@H](N)C(=O)N[C@@H](Cc2ccccc2C)C(N)=O)cc1 | 10.1021/jm901352b | |||
CHEMBL589543 | 205956 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 355 | 8 | 3 | 4 | 1.1 | COc1ccc(C[C@H](N)C(=O)N[C@@H](Cc2ccccc2C)C(N)=O)cc1 | 10.1021/jm901352b | |||
57391133 | 75142 | 0 | None | 1 | 2 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 691 | 12 | 3 | 7 | 4.4 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(=O)OCc2ccccc2)C1 | 10.1016/j.ejmech.2011.08.042 | |||
CHEMBL1916635 | 75142 | 0 | None | 1 | 2 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 691 | 12 | 3 | 7 | 4.4 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)N(C)Cc3ccccc3)N2C(=O)C(NC(=O)OCc2ccccc2)C1 | 10.1016/j.ejmech.2011.08.042 | |||
11799987 | 12090 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 514 | 9 | 2 | 3 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL106754 | 12090 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 514 | 9 | 2 | 3 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1 | 10.1021/jm970499g | |||
118731115 | 124949 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 726 | 16 | 7 | 7 | 2.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(Cc2ccccc2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408732 | 124949 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 726 | 16 | 7 | 7 | 2.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(Cc2ccccc2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44380107 | 126878 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 733 | 14 | 1 | 6 | 8.6 | CN(C)CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL350952 | 126878 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 733 | 14 | 1 | 6 | 8.6 | CN(C)CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
86274487 | 166868 | 0 | None | -933 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 408 | 2 | 0 | 7 | 3.6 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(Cl)c2)[C@@H]3C)n1 | nan | |||
CHEMBL4108583 | 166868 | 0 | None | -933 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 408 | 2 | 0 | 7 | 3.6 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(Cl)c2)[C@@H]3C)n1 | nan | |||
44318455 | 111454 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 510 | 4 | 1 | 4 | 4.7 | N#Cc1cccc(CN2CCC3(CC2)NC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL310521 | 111454 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 510 | 4 | 1 | 4 | 4.7 | N#Cc1cccc(CN2CCC3(CC2)NC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c1 | 10.1016/s0960-894x(02)00488-2 | |||
44334501 | 11781 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 567 | 2 | 0 | 4 | 4.4 | CC(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL105055 | 11781 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 567 | 2 | 0 | 4 | 4.4 | CC(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
44337207 | 14602 | 0 | None | -10 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 4.8 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL108955 | 14602 | 0 | None | -10 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 4.8 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44177669 | 68035 | 0 | None | -52 | 4 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766205 | 68035 | 0 | None | -52 | 4 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 1233 | 27 | 9 | 10 | 6.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
46889691 | 13699 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 7.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084434 | 13699 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 7.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC[C@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL589082 | 222577 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | C[C@@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||||
44611293 | 97848 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.1 | Cc1ccccc1C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397493 | 97848 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.1 | Cc1ccccc1C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44337078 | 113972 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 859 | 11 | 0 | 5 | 10.5 | O=C(CN(N1CCC(Cc2ccccc2)CC1)N1CCC(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL316552 | 113972 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 859 | 11 | 0 | 5 | 10.5 | O=C(CN(N1CCC(Cc2ccccc2)CC1)N1CCC(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL2372070 | 216956 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1016/s0960-894x(98)00219-4 | |||||
19610193 | 114009 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 654 | 10 | 1 | 7 | 5.3 | COc1cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL316740 | 114009 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 654 | 10 | 1 | 7 | 5.3 | COc1cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/s0960-894x(02)00645-5 | |||
44364001 | 46678 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 717 | 13 | 1 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CNC(=O)c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL147767 | 46678 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 717 | 13 | 1 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CNC(=O)c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44314865 | 211892 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 738 | 13 | 0 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N(C)C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL77752 | 211892 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 738 | 13 | 0 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N(C)C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44281505 | 123668 | 0 | None | -2 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 576 | 11 | 1 | 5 | 6.9 | CO/N=C(\COCc1cc(F)cc(F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33833 | 123668 | 0 | None | -2 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 576 | 11 | 1 | 5 | 6.9 | CO/N=C(\COCc1cc(F)cc(F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281334 | 126172 | 0 | None | -2 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 541 | 11 | 1 | 6 | 6.1 | CO/N=C(\COCc1ccccn1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL34460 | 126172 | 0 | None | -2 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 541 | 11 | 1 | 6 | 6.1 | CO/N=C(\COCc1ccccn1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44363909 | 42674 | 0 | None | -5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 739 | 13 | 0 | 7 | 8.5 | CCOC(=O)C1CCCN(C2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144223 | 42674 | 0 | None | -5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 739 | 13 | 0 | 7 | 8.5 | CCOC(=O)C1CCCN(C2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/s0960-894x(00)00702-2 | |||
44281587 | 60332 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 660 | 11 | 1 | 6 | 7.4 | CO/N=C(\CN(C)C(=O)c1ccc(N(C)C)c2ccccc12)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL160210 | 60332 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 660 | 11 | 1 | 6 | 7.4 | CO/N=C(\CN(C)C(=O)c1ccc(N(C)C)c2ccccc12)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
76317390 | 111386 | 0 | None | 5 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 633 | 6 | 1 | 4 | 7.4 | Cc1cc(F)ccc1-c1cc(N2CC(F)(F)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104784 | 111386 | 0 | None | 5 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 633 | 6 | 1 | 4 | 7.4 | Cc1cc(F)ccc1-c1cc(N2CC(F)(F)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
44408089 | 146964 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL380449 | 146964 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 653 | 10 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCCN1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44408051 | 148005 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 635 | 7 | 1 | 6 | 5.6 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2cc(CN3CCOCC3)on2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL382871 | 148005 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 635 | 7 | 1 | 6 | 5.6 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(Cc2cc(CN3CCOCC3)on2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44338546 | 115385 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 382 | 6 | 1 | 3 | 4.0 | Fc1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL320535 | 115385 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 382 | 6 | 1 | 3 | 4.0 | Fc1cc(COCC(c2ccccc2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
71717930 | 93137 | 0 | None | -39 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 448 | 7 | 0 | 6 | 4.3 | CCOC(=O)N(c1ccccc1)C1CCN(CCn2c(=O)n(C3CC3)c3ccccc32)CC1 | 10.1021/jm301653f | |||
CHEMBL2313631 | 93137 | 0 | None | -39 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 448 | 7 | 0 | 6 | 4.3 | CCOC(=O)N(c1ccccc1)C1CCN(CCn2c(=O)n(C3CC3)c3ccccc32)CC1 | 10.1021/jm301653f | |||
73350089 | 96183 | 0 | None | 19 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 816 | 9 | 8 | 9 | 0.5 | CCC(C)Cc1cc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1OC | 10.1021/jm00029a007 | |||
CHEMBL2370510 | 96183 | 0 | None | 19 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 816 | 9 | 8 | 9 | 0.5 | CCC(C)Cc1cc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1OC | 10.1021/jm00029a007 | |||
73354570 | 96185 | 0 | None | 13 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 814 | 8 | 8 | 9 | 0.4 | COc1ccc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1CC=C(C)C | 10.1021/jm00029a007 | |||
CHEMBL2370513 | 96185 | 0 | None | 13 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 814 | 8 | 8 | 9 | 0.4 | COc1ccc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1CC=C(C)C | 10.1021/jm00029a007 | |||
44314866 | 109682 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 718 | 13 | 1 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)Nc2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL306039 | 109682 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 718 | 13 | 1 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)Nc2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44314454 | 112394 | 0 | None | 4 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 758 | 12 | 0 | 6 | 7.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCc3ccccc3C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL312295 | 112394 | 0 | None | 4 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 758 | 12 | 0 | 6 | 7.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCc3ccccc3C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
90644614 | 119486 | 0 | None | -1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288158 | 119486 | 0 | None | -1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3304470 | 119486 | 0 | None | -1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
90644604 | 119521 | 0 | None | 12 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288153 | 119521 | 0 | None | 12 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305011 | 119521 | 0 | None | 12 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44358589 | 35792 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 386 | 9 | 1 | 6 | 2.9 | COc1cc(COCC(c2ccccc2)N2CCNCC2)cc(OC)c1OC | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138056 | 35792 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 386 | 9 | 1 | 6 | 2.9 | COc1cc(COCC(c2ccccc2)N2CCNCC2)cc(OC)c1OC | 10.1016/s0960-894x(02)00956-3 | |||
9853827 | 91996 | 0 | None | -794 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 790 | 10 | 6 | 8 | 1.5 | O=C1C[C@@H](NC(=O)CN2CCC(N3CCOCC3)CC2)C(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 | 10.1021/jm040832y | |||
CHEMBL225588 | 91996 | 0 | None | -794 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 790 | 10 | 6 | 8 | 1.5 | O=C1C[C@@H](NC(=O)CN2CCC(N3CCOCC3)CC2)C(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 | 10.1021/jm040832y | |||
9872676 | 84970 | 0 | None | -3162 | 17 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | |||
CHEMBL210514 | 84970 | 0 | None | -3162 | 17 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | |||
53472113 | 125636 | 0 | None | -630 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 519 | 4 | 0 | 7 | 6.3 | C[C@@H]1c2nnc(-c3csc(-c4ccc(F)cc4F)n3)n2CCN1C(=O)c1ccc(-c2cccs2)cc1 | 10.1021/jm5017413 | |||
CHEMBL3422009 | 125636 | 0 | None | -630 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 519 | 4 | 0 | 7 | 6.3 | C[C@@H]1c2nnc(-c3csc(-c4ccc(F)cc4F)n3)n2CCN1C(=O)c1ccc(-c2cccs2)cc1 | 10.1021/jm5017413 | |||
2132 | 10516 | 58 | None | -1659 | 6 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 382 | 5 | 2 | 3 | 5.5 | CC[C@@H](c1ccccc1)NC(=O)c1c(O)c(nc2c1cccc2)c1ccccc1 | 10.1021/jm5017413 | |||
5311424 | 10516 | 58 | None | -1659 | 6 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 382 | 5 | 2 | 3 | 5.5 | CC[C@@H](c1ccccc1)NC(=O)c1c(O)c(nc2c1cccc2)c1ccccc1 | 10.1021/jm5017413 | |||
CHEMBL10188 | 10516 | 58 | None | -1659 | 6 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 382 | 5 | 2 | 3 | 5.5 | CC[C@@H](c1ccccc1)NC(=O)c1c(O)c(nc2c1cccc2)c1ccccc1 | 10.1021/jm5017413 | |||
71533722 | 125638 | 0 | None | -891 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.7 | Cc1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)cs1 | 10.1021/jm5017413 | |||
CHEMBL3422010 | 125638 | 0 | None | -891 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.7 | Cc1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)cs1 | 10.1021/jm5017413 | |||
71549769 | 125646 | 0 | None | -3981 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 422 | 3 | 0 | 8 | 4.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | 10.1021/jm5017413 | |||
CHEMBL3422018 | 125646 | 0 | None | -3981 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 422 | 3 | 0 | 8 | 4.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | 10.1021/jm5017413 | |||
10813332 | 14546 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.0 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1F | 10.1021/jm970499g | |||
CHEMBL108933 | 14546 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.0 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1F | 10.1021/jm970499g | |||
71533722 | 125638 | 0 | None | -891 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.7 | Cc1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)cs1 | nan | |||
CHEMBL3422010 | 125638 | 0 | None | -891 | 5 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.7 | Cc1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)cs1 | nan | |||
10745123 | 17315 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 544 | 10 | 2 | 4 | 4.3 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL1169522 | 17315 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 544 | 10 | 2 | 4 | 4.3 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
44337200 | 16025 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 795 | 9 | 2 | 7 | 7.2 | O=C(CN(N1CCC(O)(c2ccccc2)CC1)N1CCC(O)(c2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL110766 | 16025 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 795 | 9 | 2 | 7 | 7.2 | O=C(CN(N1CCC(O)(c2ccccc2)CC1)N1CCC(O)(c2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
44363984 | 42442 | 0 | None | 4 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 735 | 14 | 0 | 5 | 9.3 | C=CCC1CCCN(CC2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144011 | 42442 | 0 | None | 4 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 735 | 14 | 0 | 5 | 9.3 | C=CCC1CCCN(CC2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(00)00702-2 | |||
44215306 | 43948 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 725 | 14 | 1 | 6 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2CCO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL145302 | 43948 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 725 | 14 | 1 | 6 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2CCO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44215303 | 125740 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 710 | 12 | 1 | 6 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC(C(N)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL342341 | 125740 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 710 | 12 | 1 | 6 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC(C(N)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363952 | 127789 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 696 | 12 | 1 | 6 | 7.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC[C@H]2C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL356508 | 127789 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 696 | 12 | 1 | 6 | 7.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC[C@H]2C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
118730933 | 124935 | 0 | None | -389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408519 | 124935 | 0 | None | -389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
118730933 | 124935 | 0 | None | -389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3408519 | 124935 | 0 | None | -389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
56665366 | 72682 | 0 | None | 10 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 792 | 14 | 2 | 5 | 8.5 | O=C(CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
CHEMBL1835843 | 72682 | 0 | None | 10 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 792 | 14 | 2 | 5 | 8.5 | O=C(CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
44177570 | 68034 | 0 | None | -169 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766204 | 68034 | 0 | None | -169 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1219 | 27 | 10 | 10 | 6.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44314873 | 211569 | 0 | None | 2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 12 | 1 | 7 | 6.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL74918 | 211569 | 0 | None | 2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 12 | 1 | 7 | 6.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
10395141 | 211604 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 13 | 1 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC[C@@H](CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL75367 | 211604 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 13 | 1 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC[C@@H](CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44282002 | 132284 | 0 | None | -4 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 657 | 13 | 1 | 8 | 6.3 | CO/N=C(\CN(C)C(=O)c1cc(OC)c(OC)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL36462 | 132284 | 0 | None | -4 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 657 | 13 | 1 | 8 | 6.3 | CO/N=C(\CN(C)C(=O)c1cc(OC)c(OC)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
76317390 | 111386 | 0 | None | 5 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 633 | 6 | 1 | 4 | 7.4 | Cc1cc(F)ccc1-c1cc(N2CC(F)(F)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104784 | 111386 | 0 | None | 5 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 633 | 6 | 1 | 4 | 7.4 | Cc1cc(F)ccc1-c1cc(N2CC(F)(F)C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
10651193 | 14225 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL108676 | 14225 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
11273015 | 65039 | 0 | None | -21 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 563 | 8 | 1 | 3 | 6.0 | CC(=O)NC1(c2ccccc2)CCN(C[C@@H]2C[C@@]2(C(=O)N(C)Cc2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2010.12.135 | |||
CHEMBL1682624 | 65039 | 0 | None | -21 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 563 | 8 | 1 | 3 | 6.0 | CC(=O)NC1(c2ccccc2)CCN(C[C@@H]2C[C@@]2(C(=O)N(C)Cc2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2010.12.135 | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm900473p | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm800389v | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm070332f | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm101023r | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm9602423 | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm9602423 | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm9602423 | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm9602423 | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm9602423 | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm980633c | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm980633c | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm980633c | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm980633c | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm980633c | |||
44318665 | 112927 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 531 | 3 | 1 | 4 | 5.2 | CSc1ccc(N2C(=O)NC3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2=O)cc1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL313590 | 112927 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 531 | 3 | 1 | 4 | 5.2 | CSc1ccc(N2C(=O)NC3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2=O)cc1 | 10.1016/s0960-894x(02)00488-2 | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1021/jm061369n | |||
132837 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
9461 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL22870 | 9018 | 55 | None | -18 | 5 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2009.08.035 | |||
44337514 | 12057 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 2.8 | CN1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccccc2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106555 | 12057 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 2.8 | CN1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccccc2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
15887536 | 12200 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 646 | 8 | 1 | 4 | 5.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccccc2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL107309 | 12200 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 646 | 8 | 1 | 4 | 5.9 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccccc2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
54397413 | 97841 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.0 | CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397486 | 97841 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.0 | CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
44314453 | 103859 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 758 | 13 | 1 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NC2CCc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL267333 | 103859 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 758 | 13 | 1 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NC2CCc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44314732 | 211873 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 764 | 12 | 0 | 6 | 8.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC3CCCCC32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL77592 | 211873 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 764 | 12 | 0 | 6 | 8.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC3CCCCC32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44318694 | 112803 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 4 | 1 | 3 | 6.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(Cc1cccc(-c3ccccc3)c1)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL313297 | 112803 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 4 | 1 | 3 | 6.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(Cc1cccc(-c3ccccc3)c1)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
44408864 | 83296 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 451 | 4 | 1 | 1 | 7.3 | CC(C)(C(=O)Nc1ccccc1-c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206016 | 83296 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 451 | 4 | 1 | 1 | 7.3 | CC(C)(C(=O)Nc1ccccc1-c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44363990 | 23084 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 749 | 14 | 0 | 5 | 9.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CC3CC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL122643 | 23084 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 749 | 14 | 0 | 5 | 9.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CC3CC3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363982 | 42440 | 0 | None | 2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 683 | 12 | 0 | 6 | 7.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCOCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144010 | 42440 | 0 | None | 2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 683 | 12 | 0 | 6 | 7.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCOCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363442 | 44714 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL145959 | 44714 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
24768353 | 104524 | 0 | None | -21 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 941 | 22 | 9 | 9 | 2.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm070332f | |||
CHEMBL271619 | 104524 | 0 | None | -21 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 941 | 22 | 9 | 9 | 2.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm070332f | |||
44233185 | 201601 | 0 | None | -181 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL539193 | 201601 | 0 | None | -181 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1327 | 29 | 14 | 16 | 1.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
10394952 | 111526 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 696 | 12 | 0 | 6 | 7.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL310703 | 111526 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 696 | 12 | 0 | 6 | 7.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44314486 | 112433 | 0 | None | 6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 739 | 13 | 0 | 7 | 6.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(N(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL312528 | 112433 | 0 | None | 6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 739 | 13 | 0 | 7 | 6.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(N(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
9987474 | 211612 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 13 | 1 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC[C@H](CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL75436 | 211612 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 726 | 13 | 1 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC[C@H](CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44177670 | 68036 | 0 | None | -190 | 4 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766206 | 68036 | 0 | None | -190 | 4 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 1151 | 27 | 10 | 10 | 5.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
44281345 | 117257 | 0 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 554 | 11 | 1 | 5 | 7.0 | CO/N=C(\COCc1cccc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32477 | 117257 | 0 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 554 | 11 | 1 | 5 | 7.0 | CO/N=C(\COCc1cccc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44337353 | 12199 | 0 | None | -9 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 7 | 2 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)c4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL107306 | 12199 | 0 | None | -9 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 7 | 2 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)c4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL388265 | 219194 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1021/jm901352b | |||||
44318677 | 212473 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 531 | 3 | 0 | 3 | 4.9 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3ccccc3F)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL82278 | 212473 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 531 | 3 | 0 | 3 | 4.9 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3ccccc3F)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
44337080 | 117375 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 945 | 11 | 2 | 7 | 8.8 | CC(=O)NC1(c2ccccc2)CCN(N(CC(=O)N2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2c2ccc(Cl)c(Cl)c2)N2CCC(NC(C)=O)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL325547 | 117375 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 945 | 11 | 2 | 7 | 8.8 | CC(=O)NC1(c2ccccc2)CCN(N(CC(=O)N2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2c2ccc(Cl)c(Cl)c2)N2CCC(NC(C)=O)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00645-5 | |||
44380313 | 64865 | 0 | None | 15 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 647 | 10 | 1 | 4 | 8.3 | O=C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL167409 | 64865 | 0 | None | 15 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 647 | 10 | 1 | 4 | 8.3 | O=C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380095 | 127634 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 687 | 11 | 1 | 6 | 8.6 | N#CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL355868 | 127634 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 687 | 11 | 1 | 6 | 8.6 | N#CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44337174 | 14655 | 0 | None | -11 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 5.8 | CC(=O)Nc1ccc(CN2CCC(NCC(=O)N3CCN(C(=O)c4cc(C)cc(C)c4)C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL108997 | 14655 | 0 | None | -11 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 5.8 | CC(=O)Nc1ccc(CN2CCC(NCC(=O)N3CCN(C(=O)c4cc(C)cc(C)c4)C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 | 10.1016/s0960-894x(02)00645-5 | |||
9566253 | 82285 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 414 | 4 | 1 | 5 | 6.1 | Cc1onc(-c2c(Cl)cccc2Cl)c1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL204327 | 82285 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 414 | 4 | 1 | 5 | 6.1 | Cc1onc(-c2c(Cl)cccc2Cl)c1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL3609617 | 218610 | 0 | None | -501 | 4 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
73212437 | 111388 | 0 | None | 630 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 4.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](C(=O)NCCN1CCOCC1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104786 | 111388 | 0 | None | 630 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 4.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](C(=O)NCCN1CCOCC1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
90644632 | 118723 | 0 | None | 7 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 698 | 12 | 3 | 6 | 5.6 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCO)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288168 | 118723 | 0 | None | 7 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 698 | 12 | 3 | 6 | 5.6 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCO)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
90644628 | 119511 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.4 | CNCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
CHEMBL3288165 | 119511 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.4 | CNCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
CHEMBL3304854 | 119511 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.4 | CNCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
10141196 | 33573 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 4.7 | O=C(O)CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136291 | 33573 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 4.7 | O=C(O)CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
135530616 | 36565 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 529 | 8 | 2 | 6 | 4.6 | Oc1n[nH]c(CN2CCN(C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc3)CC2)n1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138716 | 36565 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 529 | 8 | 2 | 6 | 4.6 | Oc1n[nH]c(CN2CCN(C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc3)CC2)n1 | 10.1016/s0960-894x(02)00956-3 | |||
10230370 | 37367 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 534 | 11 | 1 | 5 | 4.7 | O=C(O)COCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139382 | 37367 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 534 | 11 | 1 | 5 | 4.7 | O=C(O)COCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358408 | 37744 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 545 | 9 | 0 | 5 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(CCN3CCOCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139859 | 37744 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 545 | 9 | 0 | 5 | 4.9 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(CCN3CCOCC3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358597 | 38234 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1ccc(COCC(c2ccccc2)N2CCNCC2)c(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL140302 | 38234 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 1 | 3 | 4.9 | FC(F)(F)c1ccc(COCC(c2ccccc2)N2CCNCC2)c(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
9852911 | 106159 | 0 | None | 8 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 678 | 20 | 2 | 7 | 7.4 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm0205088 | |||
CHEMBL282618 | 106159 | 0 | None | 8 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 678 | 20 | 2 | 7 | 7.4 | NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 | 10.1021/jm0205088 | |||
10085946 | 172119 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 296 | 7 | 2 | 3 | 3.3 | CNC(c1ccccc1)C1(NCc2ccccc2OC)CC1 | 10.1016/s0960-894x(01)00020-8 | |||
CHEMBL423597 | 172119 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 296 | 7 | 2 | 3 | 3.3 | CNC(c1ccccc1)C1(NCc2ccccc2OC)CC1 | 10.1016/s0960-894x(01)00020-8 | |||
25222441 | 203920 | 0 | None | -30 | 4 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 589 | 8 | 0 | 3 | 6.4 | CC(=O)N(C)C1CCN(CCC(C)(C(=O)N(C)Cc2ccc(F)c(C(F)(F)F)c2)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm900948q | |||
CHEMBL567849 | 203920 | 0 | None | -30 | 4 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 589 | 8 | 0 | 3 | 6.4 | CC(=O)N(C)C1CCN(CCC(C)(C(=O)N(C)Cc2ccc(F)c(C(F)(F)F)c2)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm900948q | |||
118730936 | 124938 | 0 | None | -16982 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 684 | 14 | 7 | 7 | 1.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408522 | 124938 | 0 | None | -16982 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 684 | 14 | 7 | 7 | 1.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
10552479 | 115780 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 474 | 7 | 2 | 4 | 4.8 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL321215 | 115780 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 474 | 7 | 2 | 4 | 4.8 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
44315267 | 112282 | 0 | None | -63 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 701 | 11 | 1 | 7 | 8.5 | CO/N=C(\CN(C(=O)c1cc(Cl)cc(Cl)c1)C1CC1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL312141 | 112282 | 0 | None | -63 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 701 | 11 | 1 | 7 | 8.5 | CO/N=C(\CN(C(=O)c1cc(Cl)cc(Cl)c1)C1CC1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44358421 | 36525 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 4.5 | FC(F)(F)c1cc(COCC(c2ccco2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138682 | 36525 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 4.5 | FC(F)(F)c1cc(COCC(c2ccco2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44363962 | 42704 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 753 | 14 | 0 | 7 | 8.7 | CCOC(=O)C1CCCN(CC2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144249 | 42704 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 753 | 14 | 0 | 7 | 8.7 | CCOC(=O)C1CCCN(CC2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/s0960-894x(00)00702-2 | |||
44363949 | 127720 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 683 | 11 | 0 | 5 | 8.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2=S)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL356105 | 127720 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 683 | 11 | 0 | 5 | 8.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2=S)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44314502 | 211576 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 712 | 12 | 1 | 7 | 5.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL75018 | 211576 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 712 | 12 | 1 | 7 | 5.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
10531434 | 14231 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 587 | 9 | 3 | 3 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL108683 | 14231 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 587 | 9 | 3 | 3 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
51351504 | 67383 | 1 | None | -4 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 410 | 4 | 0 | 5 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n(C)n2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL1760206 | 67383 | 1 | None | -4 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 410 | 4 | 0 | 5 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n(C)n2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
118731119 | 124953 | 0 | None | -162181 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 686 | 17 | 7 | 7 | 1.5 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)N(C)CC(=O)N(C)Cc1ccccc1 | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408736 | 124953 | 0 | None | -162181 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 686 | 17 | 7 | 7 | 1.5 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)N(C)CC(=O)N(C)Cc1ccccc1 | 10.1016/j.ejmech.2014.12.033 | |||
44351946 | 124147 | 1 | None | -1778 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 568 | 8 | 0 | 3 | 7.3 | CCN1C(=O)c2ccccc2[C@H]1[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm020094i | |||
CHEMBL339767 | 124147 | 1 | None | -1778 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 568 | 8 | 0 | 3 | 7.3 | CCN1C(=O)c2ccccc2[C@H]1[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm020094i | |||
44281784 | 120270 | 0 | None | -6 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 690 | 10 | 1 | 6 | 8.3 | CO/N=C(\COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33198 | 120270 | 0 | None | -6 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 690 | 10 | 1 | 6 | 8.3 | CO/N=C(\COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44318865 | 212919 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 671 | 7 | 0 | 7 | 3.8 | COc1ccc(N2CN(CC(=O)N3CCC4(CC3)C(=O)N(C)C(=O)N4Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2=O)cc1OC | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL86053 | 212919 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 671 | 7 | 0 | 7 | 3.8 | COc1ccc(N2CN(CC(=O)N3CCC4(CC3)C(=O)N(C)C(=O)N4Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2=O)cc1OC | 10.1016/s0960-894x(02)00488-2 | |||
44380094 | 65518 | 0 | None | 3 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 719 | 13 | 2 | 6 | 7.6 | NC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168584 | 65518 | 0 | None | 3 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 719 | 13 | 2 | 6 | 7.6 | NC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
141952732 | 127243 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 734 | 13 | 3 | 7 | 7.8 | N/C(CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)=N/O | 10.1016/s0960-894x(02)00027-6 | |||
44380527 | 127243 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 734 | 13 | 3 | 7 | 7.8 | N/C(CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)=N/O | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354091 | 127243 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 734 | 13 | 3 | 7 | 7.8 | N/C(CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)=N/O | 10.1016/s0960-894x(02)00027-6 | |||
44337467 | 116992 | 0 | None | 17 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 821 | 13 | 2 | 7 | 7.8 | O=C(CN(NC1CCN(Cc2ccccc2)CC1)NC1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL323741 | 116992 | 0 | None | 17 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 821 | 13 | 2 | 7 | 7.8 | O=C(CN(NC1CCN(Cc2ccccc2)CC1)NC1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
44363936 | 26807 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 782 | 14 | 1 | 7 | 9.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(OC(=O)NC(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL130354 | 26807 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 782 | 14 | 1 | 7 | 9.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(OC(=O)NC(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
9868422 | 177058 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 4 | 0 | 1 | 7.0 | Cc1ccccc1-c1ccccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL444624 | 177058 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 4 | 0 | 1 | 7.0 | Cc1ccccc1-c1ccccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
10507771 | 116515 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1cccc2ccccc12)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL322975 | 116515 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1cccc2ccccc12)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
73353537 | 97845 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.3 | C[C@@H](c1ccccc1)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397490 | 97845 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.3 | C[C@@H](c1ccccc1)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
10790280 | 115396 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 6 | 2 | 2 | 5.1 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL320583 | 115396 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 6 | 2 | 2 | 5.1 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
10649307 | 117145 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 507 | 6 | 2 | 2 | 5.2 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1C(=S)NCc1ccccc1Br | 10.1021/jm970499g | |||
CHEMBL324177 | 117145 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 507 | 6 | 2 | 2 | 5.2 | O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCN1C(=S)NCc1ccccc1Br | 10.1021/jm970499g | |||
10531273 | 15971 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 578 | 9 | 3 | 4 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(=O)O | 10.1021/jm970499g | |||
CHEMBL110393 | 15971 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 578 | 9 | 3 | 4 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(=O)O | 10.1021/jm970499g | |||
71549913 | 125634 | 0 | None | -1737 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 415 | 3 | 0 | 6 | 4.6 | Cc1cccc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | nan | |||
CHEMBL3422007 | 125634 | 0 | None | -1737 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 415 | 3 | 0 | 6 | 4.6 | Cc1cccc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | nan | |||
44408725 | 172847 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 375 | 4 | 1 | 3 | 6.2 | Clc1ccccc1-c1ccccc1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL425768 | 172847 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 375 | 4 | 1 | 3 | 6.2 | Clc1ccccc1-c1ccccc1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
7088456 | 206306 | 1 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL592133 | 206306 | 1 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
44363908 | 42557 | 0 | None | -4 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 681 | 11 | 0 | 5 | 8.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144116 | 42557 | 0 | None | -4 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 681 | 11 | 0 | 5 | 8.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363756 | 46611 | 0 | None | 8 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 703 | 12 | 1 | 5 | 8.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(NC(=O)c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL147715 | 46611 | 0 | None | 8 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 703 | 12 | 1 | 5 | 8.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(NC(=O)c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44138558 | 199817 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL522292 | 199817 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 477 | 3 | 1 | 2 | 5.4 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
10189341 | 16891 | 0 | None | 10 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
CHEMBL115633 | 16891 | 0 | None | 10 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
10746177 | 13795 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 602 | 8 | 2 | 3 | 6.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(F)(F)F | 10.1021/jm970499g | |||
CHEMBL108481 | 13795 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 602 | 8 | 2 | 3 | 6.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1C(F)(F)F | 10.1021/jm970499g | |||
11100291 | 184456 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 353 | 8 | 3 | 3 | 0.9 | CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||
CHEMBL464178 | 184456 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 353 | 8 | 3 | 3 | 0.9 | CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||
10649931 | 14647 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 531 | 9 | 3 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=N)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL108990 | 14647 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 531 | 9 | 3 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=N)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL2371916 | 216931 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(N)=O | 10.1021/jm00391a046 | |||||
20906619 | 67442 | 7 | None | -7 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL1760338 | 67442 | 7 | None | -7 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
73353047 | 96181 | 0 | None | 1 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 746 | 6 | 8 | 9 | -1.1 | COc1ccc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1 | 10.1021/jm00029a007 | |||
CHEMBL2370509 | 96181 | 0 | None | 1 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 746 | 6 | 8 | 9 | -1.1 | COc1ccc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1 | 10.1021/jm00029a007 | |||
44314547 | 109652 | 0 | None | 5 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 661 | 11 | 0 | 5 | 8.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL305826 | 109652 | 0 | None | 5 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 661 | 11 | 0 | 5 | 8.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
25221995 | 203630 | 0 | None | -67 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 601 | 8 | 0 | 3 | 6.5 | CN(Cc1ccc(F)c(C(F)(F)F)c1)C(=O)C(C)(CCN1CCC(N2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm900948q | |||
CHEMBL565894 | 203630 | 0 | None | -67 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 601 | 8 | 0 | 3 | 6.5 | CN(Cc1ccc(F)c(C(F)(F)F)c1)C(=O)C(C)(CCN1CCC(N2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm900948q | |||
46228976 | 205923 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 297 | 6 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)c1ccccc1 | 10.1021/jm901352b | |||
CHEMBL589329 | 205923 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 297 | 6 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)c1ccccc1 | 10.1021/jm901352b | |||
15487997 | 97837 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 325 | 8 | 3 | 3 | 1.0 | CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397482 | 97837 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 325 | 8 | 3 | 3 | 1.0 | CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44363925 | 46837 | 0 | None | 3 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 754 | 13 | 1 | 7 | 8.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC(OC(=O)NC(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL147924 | 46837 | 0 | None | 3 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 754 | 13 | 1 | 7 | 8.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC(OC(=O)NC(C)C)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44314871 | 112470 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 712 | 12 | 0 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCOCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL312573 | 112470 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 712 | 12 | 0 | 7 | 6.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCOCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
90644630 | 118721 | 0 | None | 50 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 725 | 13 | 2 | 6 | 6.2 | CN(C)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
CHEMBL3288166 | 118721 | 0 | None | 50 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 725 | 13 | 2 | 6 | 6.2 | CN(C)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
90644620 | 119568 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288161 | 119568 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305870 | 119568 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44407901 | 147222 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 701 | 10 | 1 | 6 | 6.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL380928 | 147222 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 701 | 10 | 1 | 6 | 6.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44358409 | 126120 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 475 | 6 | 1 | 3 | 4.7 | NC(=O)N1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL344265 | 126120 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 475 | 6 | 1 | 3 | 4.7 | NC(=O)N1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
46224928 | 206181 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 515 | 2 | 1 | 2 | 6.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCC=CC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591074 | 206181 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 515 | 2 | 1 | 2 | 6.2 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCC=CC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
54583959 | 67443 | 0 | None | -3 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 410 | 5 | 1 | 4 | 3.7 | COc1ccccc1CN1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL1760339 | 67443 | 0 | None | -3 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 410 | 5 | 1 | 4 | 3.7 | COc1ccccc1CN1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
90644606 | 119567 | 0 | None | 6 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288154 | 119567 | 0 | None | 6 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305869 | 119567 | 0 | None | 6 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 683 | 11 | 2 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44338530 | 16129 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 332 | 6 | 1 | 3 | 3.1 | Fc1cc(F)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL111303 | 16129 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 332 | 6 | 1 | 3 | 3.1 | Fc1cc(F)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
11239751 | 91946 | 0 | None | -1995 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 785 | 10 | 7 | 8 | -0.5 | NS(=O)(=O)N1CCN(CC(=O)N[C@@H]2CC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@H](Cc3ccccc3)CNC2=O)CC1 | 10.1021/jm040832y | |||
CHEMBL225297 | 91946 | 0 | None | -1995 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 785 | 10 | 7 | 8 | -0.5 | NS(=O)(=O)N1CCN(CC(=O)N[C@@H]2CC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@H](Cc3ccccc3)CNC2=O)CC1 | 10.1021/jm040832y | |||
44322610 | 213424 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 462 | 5 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1021/jm058225d | |||
CHEMBL89245 | 213424 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 462 | 5 | 1 | 2 | 5.6 | O=C(CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(c1ccc(F)cc1)C1CCNCC1 | 10.1021/jm058225d | |||
86274490 | 166665 | 0 | None | -1000 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 392 | 2 | 0 | 7 | 3.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(F)c2)[C@@H]3C)n1 | nan | |||
CHEMBL4106866 | 166665 | 0 | None | -1000 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 392 | 2 | 0 | 7 | 3.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(F)c2)[C@@H]3C)n1 | nan | |||
44315210 | 109695 | 0 | None | 1 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 747 | 14 | 0 | 8 | 8.0 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL306124 | 109695 | 0 | None | 1 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 747 | 14 | 0 | 8 | 8.0 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CCOC)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44409023 | 146996 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | Cc1ccccc1-c1ccc(N2CCN(C)CC2)nc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL380510 | 146996 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 578 | 5 | 0 | 4 | 6.8 | Cc1ccccc1-c1ccc(N2CCN(C)CC2)nc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44560754 | 179976 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 5.9 | C[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL452269 | 179976 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 445 | 5 | 1 | 2 | 5.9 | C[C@@H]1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2008.05.082 | |||
10359664 | 120779 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 336 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)NC1 | 10.1021/jm00051a001 | |||
CHEMBL332644 | 120779 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 336 | 3 | 2 | 3 | 4.0 | COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)NC1 | 10.1021/jm00051a001 | |||
9896563 | 110557 | 0 | None | 5 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CCC(/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL308891 | 110557 | 0 | None | 5 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 711 | 12 | 1 | 6 | 6.4 | CNC(=O)CC1CCCN(C2CCN(CCC(/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O | 10.1016/s0960-894x(02)00340-2 | |||
9810288 | 210470 | 0 | None | 8 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL67508 | 210470 | 0 | None | 8 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 6.1 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(N)=O)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44281633 | 106763 | 0 | None | 3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 664 | 11 | 1 | 7 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(-c2cccs2)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL286646 | 106763 | 0 | None | 3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 664 | 11 | 1 | 7 | 7.7 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(-c2cccs2)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281649 | 115797 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 625 | 11 | 1 | 7 | 6.0 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(N(C)C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32124 | 115797 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 625 | 11 | 1 | 7 | 6.0 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(N(C)C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281666 | 115982 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 635 | 10 | 1 | 5 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32163 | 115982 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 635 | 10 | 1 | 5 | 7.5 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281650 | 120574 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 651 | 11 | 1 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(N2CCCC2)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33243 | 120574 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 651 | 11 | 1 | 7 | 6.5 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(N2CCCC2)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
10394882 | 120589 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 689 | 10 | 2 | 5 | 7.9 | CO/N=C(\CNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33249 | 120589 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 689 | 10 | 2 | 5 | 7.9 | CO/N=C(\CNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
52943090 | 24933 | 0 | None | 79 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 666 | 5 | 0 | 4 | 4.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)N2CCN(S(C)(=O)=O)CC2)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
CHEMBL1269640 | 24933 | 0 | None | 79 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 666 | 5 | 0 | 4 | 4.8 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CN(C(=O)N2CCN(S(C)(=O)=O)CC2)C[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2010.08.138 | |||
71453994 | 90309 | 0 | None | 10 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 583 | 5 | 1 | 4 | 6.7 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203706 | 90309 | 0 | None | 10 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 583 | 5 | 1 | 4 | 6.7 | Cc1cc(F)ccc1-c1cc(N2CC[C@H](O)C2)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
44380413 | 103371 | 0 | None | 21 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 741 | 15 | 1 | 7 | 6.2 | COCCNC(=O)CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL263214 | 103371 | 0 | None | 21 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 741 | 15 | 1 | 7 | 6.2 | COCCNC(=O)CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380249 | 127122 | 0 | None | 3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 706 | 12 | 1 | 6 | 7.3 | CN(C/C(=N\OCc1c[nH]cn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL353027 | 127122 | 0 | None | 3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 706 | 12 | 1 | 6 | 7.3 | CN(C/C(=N\OCc1c[nH]cn1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
127034831 | 143291 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(C)C(=O)NCC(=O)N(C)C(Cc1ccccc1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c01456 | |||
CHEMBL3736287 | 143291 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(C)C(=O)NCC(=O)N(C)C(Cc1ccccc1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c01456 | |||
72734611 | 97759 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL2396664 | 97759 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
72734611 | 97759 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL2396664 | 97759 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/ml5002954 | |||
127032846 | 145569 | 0 | None | 4 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1081 | 24 | 9 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780818 | 145569 | 0 | None | 4 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1081 | 24 | 9 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
145948744 | 174254 | 0 | None | -2 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299371 | 174254 | 0 | None | -2 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
72734611 | 97759 | 0 | None | -1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
CHEMBL2396664 | 97759 | 0 | None | -1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
72734611 | 97759 | 0 | None | -1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2396664 | 97759 | 0 | None | -1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
10769060 | 12806 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1 | 10.1021/jm970499g | |||
CHEMBL108040 | 12806 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1 | 10.1021/jm970499g | |||
11353915 | 13725 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 601 | 9 | 1 | 4 | 7.6 | CCCN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084525 | 13725 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 601 | 9 | 1 | 4 | 7.6 | CCCN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
46889692 | 13700 | 0 | None | 12 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 7.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC[C@@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084435 | 13700 | 0 | None | 12 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 7.7 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CCCC[C@@H]2CO)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44315209 | 211690 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 728 | 12 | 0 | 8 | 7.9 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC#N)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76093 | 211690 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 728 | 12 | 0 | 8 | 7.9 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC#N)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44178113 | 68038 | 0 | None | -12 | 3 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
CHEMBL1766208 | 68038 | 0 | None | -12 | 3 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1237 | 27 | 10 | 11 | 5.6 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm101023r | |||
10793340 | 12497 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 | 10.1021/jm970499g | |||
CHEMBL107830 | 12497 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 579 | 9 | 2 | 5 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 | 10.1021/jm970499g | |||
10817098 | 117305 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL325106 | 117305 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)NCc1ccccc1Cl | 10.1021/jm970499g | |||
44380090 | 127498 | 0 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 684 | 13 | 0 | 6 | 7.0 | COCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354771 | 127498 | 0 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 684 | 13 | 0 | 6 | 7.0 | COCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44315422 | 109916 | 0 | None | 2 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 747 | 13 | 1 | 8 | 7.5 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL307877 | 109916 | 0 | None | 2 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 747 | 13 | 1 | 8 | 7.5 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(=O)O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44315591 | 211753 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 746 | 13 | 1 | 8 | 6.9 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(N)=O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76529 | 211753 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 746 | 13 | 1 | 8 | 6.9 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(CC(N)=O)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44315299 | 211790 | 0 | None | -1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 737 | 12 | 0 | 6 | 8.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccsc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL76823 | 211790 | 0 | None | -1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 737 | 12 | 0 | 6 | 8.4 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(N2CCCN(Cc3ccsc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
9940831 | 21418 | 0 | None | 1 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL1205204 | 21418 | 0 | None | 1 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL65468 | 21418 | 0 | None | 1 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
10237920 | 86617 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 416 | 5 | 0 | 2 | 6.1 | C[C@@H](OCC1(c2ccccc2)CC(=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL212173 | 86617 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 416 | 5 | 0 | 2 | 6.1 | C[C@@H](OCC1(c2ccccc2)CC(=O)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
9927183 | 202384 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1016/S0960-894X(01)80386-3 | |||
CHEMBL55591 | 202384 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 3.7 | COc1ccccc1CN[C@@H]1[C@H](c2ccccc2)N[C@H]2CCC[C@H]21 | 10.1016/S0960-894X(01)80386-3 | |||
44315572 | 109758 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 689 | 11 | 1 | 7 | 8.3 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL306624 | 109758 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 689 | 11 | 1 | 7 | 8.3 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
145948965 | 174267 | 0 | None | 1 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1183 | 22 | 9 | 9 | 6.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299476 | 174267 | 0 | None | 1 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1183 | 22 | 9 | 9 | 6.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
11794060 | 125976 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.5 | COc1ccc(-c2nnn(C)n2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
CHEMBL343219 | 125976 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 2 | 7 | 2.5 | COc1ccc(-c2nnn(C)n2)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 10.1021/jm00026a005 | |||
86302473 | 119525 | 0 | None | 3 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 697 | 11 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288169 | 119525 | 0 | None | 3 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 697 | 11 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305156 | 119525 | 0 | None | 3 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 697 | 11 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44408040 | 81194 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 637 | 7 | 1 | 6 | 5.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC2=NOC(CN3CCOCC3)C2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL202627 | 81194 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 637 | 7 | 1 | 6 | 5.1 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(CC2=NOC(CN3CCOCC3)C2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
9874480 | 81548 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 661 | 9 | 3 | 4 | 6.1 | COc1ccccc1CNCCNC(=O)N1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL203113 | 81548 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 661 | 9 | 3 | 4 | 6.1 | COc1ccccc1CNCCNC(=O)N1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
44407908 | 147335 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 687 | 9 | 1 | 7 | 4.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCS(=O)(=O)CC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381155 | 147335 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 687 | 9 | 1 | 7 | 4.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCS(=O)(=O)CC1 | 10.1016/j.bmcl.2005.10.077 | |||
44358317 | 123315 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 488 | 9 | 0 | 3 | 6.4 | CCCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL336251 | 123315 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 488 | 9 | 0 | 3 | 6.4 | CCCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358425 | 172225 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.3 | C[C@H](OC[C@@H](c1ccccc1)N1CCN(CCOCC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL423913 | 172225 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.3 | C[C@H](OC[C@@H](c1ccccc1)N1CCN(CCOCC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
145948839 | 174258 | 0 | None | -6 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1137 | 22 | 8 | 9 | 5.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299415 | 174258 | 0 | None | -6 | 4 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 1137 | 22 | 8 | 9 | 5.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44560774 | 179749 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 4.1 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](NS(C)(=O)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
CHEMBL451764 | 179749 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 524 | 7 | 2 | 4 | 4.1 | C[C@@H](OC[C@@]1(c2ccccc2)C[C@@H](NS(C)(=O)=O)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2008.05.082 | |||
73348949 | 97597 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.0 | Ic1ccccc1N[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2013.01.025 | |||
CHEMBL2392023 | 97597 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 494 | 5 | 1 | 2 | 6.0 | Ic1ccccc1N[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2013.01.025 | |||
10816496 | 11975 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 550 | 8 | 3 | 4 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1O | 10.1021/jm970499g | |||
CHEMBL106100 | 11975 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 550 | 8 | 3 | 4 | 4.9 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1O | 10.1021/jm970499g | |||
46889669 | 13783 | 0 | None | 2 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 585 | 5 | 1 | 4 | 7.0 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@@H](O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1084771 | 13783 | 0 | None | 2 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 585 | 5 | 1 | 4 | 7.0 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2CC[C@@H](O)C2)cc1-c1ccccc1Cl | 10.1016/j.bmcl.2010.04.008 | |||
44315231 | 112176 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 780 | 13 | 0 | 8 | 8.8 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(Cc3ccccn3)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL311712 | 112176 | 0 | None | 1 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 780 | 13 | 0 | 8 | 8.8 | CCN(C/C(=N\OC)[C@H](CCN1CCC(n2c(=O)n(Cc3ccccn3)c3ccccc32)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44408062 | 147334 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL381151 | 147334 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
10600310 | 93134 | 0 | None | 13 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 466 | 7 | 0 | 5 | 4.9 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)CC)c3cccc(Cl)c3)CC2)c2ccccc21 | 10.1021/jm301653f | |||
CHEMBL2313628 | 93134 | 0 | None | 13 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 466 | 7 | 0 | 5 | 4.9 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)CC)c3cccc(Cl)c3)CC2)c2ccccc21 | 10.1021/jm301653f | |||
44380248 | 64937 | 0 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 720 | 13 | 0 | 7 | 7.3 | CN(C/C(=N\OCCn1ccnc1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168144 | 64937 | 0 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 720 | 13 | 0 | 7 | 7.3 | CN(C/C(=N\OCCn1ccnc1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
71457524 | 90308 | 0 | None | -5 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL2203705 | 90308 | 0 | None | -5 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 597 | 6 | 1 | 4 | 7.1 | Cc1cc(F)ccc1-c1cc(N2CCC[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm2017072 | |||
CHEMBL3609619 | 218612 | 0 | None | 34 | 3 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
145948981 | 174270 | 0 | None | 1 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1139 | 22 | 9 | 9 | 6.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299483 | 174270 | 0 | None | 1 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1139 | 22 | 9 | 9 | 6.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
9874473 | 48582 | 0 | None | 16 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
CHEMBL149326 | 48582 | 0 | None | 16 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
44380732 | 65766 | 0 | None | -1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 706 | 13 | 2 | 6 | 8.1 | OCCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL169002 | 65766 | 0 | None | -1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 706 | 13 | 2 | 6 | 8.1 | OCCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44363436 | 42489 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 711 | 12 | 0 | 5 | 9.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2=S)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144057 | 42489 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 711 | 12 | 0 | 5 | 9.2 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2=S)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363979 | 127761 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 711 | 13 | 1 | 6 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL356268 | 127761 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 711 | 13 | 1 | 6 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
10484667 | 211334 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL72930 | 211334 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL2370435 | 216628 | 0 | None | -48 | 2 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O | 10.1021/jm00073a022 | |||||
44314578 | 211927 | 0 | None | 13 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 726 | 14 | 1 | 7 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NCC2CCCO2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL78091 | 211927 | 0 | None | 13 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 726 | 14 | 1 | 7 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NCC2CCCO2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL5271987 | 200483 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 761 | 12 | 5 | 7 | 6.2 | CC(C)C[C@H](NC(=O)CNC(=O)OCc1ccccc1)C(=O)NC1(C(=O)OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CNc2[nH]c3ccccc3c2C1 | 10.1021/acs.jmedchem.6b01029 | |||
13821356 | 113497 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 995 | 25 | 10 | 16 | 0.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)C(N)=O | 10.1021/jm00391a046 | |||
CHEMBL3144091 | 113497 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 995 | 25 | 10 | 16 | 0.5 | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)C(N)=O | 10.1021/jm00391a046 | |||
44318578 | 212471 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 521 | 8 | 1 | 3 | 5.6 | CCCCCCCCN1C(=O)NC2(CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL82274 | 212471 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 521 | 8 | 1 | 3 | 5.6 | CCCCCCCCN1C(=O)NC2(CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm900948q | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm900948q | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm900948q | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm900948q | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm900948q | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm2017072 | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm2017072 | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm2017072 | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm2017072 | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm2017072 | |||
44337330 | 12104 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 4.8 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@@H](N)Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106816 | 12104 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 649 | 8 | 2 | 5 | 4.8 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@@H](N)Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
86275688 | 155086 | 0 | None | -794 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 408 | 2 | 0 | 7 | 3.6 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(Cl)c2)C3C)n1 | nan | |||
CHEMBL3936869 | 155086 | 0 | None | -794 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 408 | 2 | 0 | 7 | 3.6 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)c(Cl)c2)C3C)n1 | nan | |||
18393120 | 12032 | 0 | None | -10 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 502 | 5 | 2 | 4 | 4.0 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCNCC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106404 | 12032 | 0 | None | -10 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 502 | 5 | 2 | 4 | 4.0 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCNCC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44408736 | 147664 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 471 | 4 | 0 | 1 | 7.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL382043 | 147664 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 471 | 4 | 0 | 1 | 7.3 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
44314503 | 211772 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 698 | 12 | 1 | 7 | 5.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL76704 | 211772 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 698 | 12 | 1 | 7 | 5.5 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL5083565 | 221650 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | C[C@@H](O[C@H]1O[C@@H]2CC[C@@H](c3ccccc3)O[C@@H]2[C@H](O)[C@H]1OCc1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.1c00793 | |||||
10839138 | 93135 | 0 | None | -11 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 7 | 0 | 5 | 5.5 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)CC)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | 10.1021/jm301653f | |||
CHEMBL2313629 | 93135 | 0 | None | -11 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 7 | 0 | 5 | 5.5 | C=C(C)n1c(=O)n(CCN2CCC(N(C(=O)CC)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | 10.1021/jm301653f | |||
51351496 | 67382 | 7 | None | -4 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 410 | 4 | 0 | 5 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)nn2C)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL1760205 | 67382 | 7 | None | -4 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 410 | 4 | 0 | 5 | 3.7 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)nn2C)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
86274732 | 129773 | 0 | None | -691 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 388 | 4 | 1 | 8 | 1.8 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3CCO)n1 | nan | |||
CHEMBL3608741 | 129773 | 0 | None | -691 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 388 | 4 | 1 | 8 | 1.8 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3CCO)n1 | nan | |||
86274727 | 167562 | 0 | None | -912 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 392 | 2 | 0 | 7 | 3.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)c(Cl)c2)[C@@H]3C)n1 | nan | |||
CHEMBL4114280 | 167562 | 0 | None | -912 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 392 | 2 | 0 | 7 | 3.1 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)c(Cl)c2)[C@@H]3C)n1 | nan | |||
18546500 | 83482 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 410 | 5 | 0 | 1 | 7.1 | FC(F)(F)c1cc(COCc2ccccc2-c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206490 | 83482 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 410 | 5 | 0 | 1 | 7.1 | FC(F)(F)c1cc(COCc2ccccc2-c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
46228975 | 208411 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 297 | 6 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)c1ccccc1 | 10.1021/jm901352b | |||
CHEMBL605906 | 208411 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 297 | 6 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)c1ccccc1 | 10.1021/jm901352b | |||
44334665 | 174776 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 583 | 6 | 1 | 5 | 4.0 | O=C1C2CN(C(=O)COCc3ccccc3)C3(CCNCC3)C2C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL432007 | 174776 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 583 | 6 | 1 | 5 | 4.0 | O=C1C2CN(C(=O)COCc3ccccc3)C3(CCNCC3)C2C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
44337308 | 12218 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 5.6 | O=C(c1cc(F)cc(F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL107407 | 12218 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 5.6 | O=C(c1cc(F)cc(F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL2372065 | 216954 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)N1C2CC3CCC2(CS1(=O)=O)C3(C)C)[C@@H](Cc1ccc(Cc2ccccc2)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1016/s0960-894x(98)00219-4 | |||||
44233184 | 201547 | 0 | None | -12 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL538131 | 201547 | 0 | None | -12 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1343 | 32 | 15 | 16 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
44314504 | 109693 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 682 | 12 | 0 | 6 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL306121 | 109693 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 682 | 12 | 0 | 6 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44281357 | 118510 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 660 | 10 | 1 | 4 | 9.1 | CO/N=C(\CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32872 | 118510 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 660 | 10 | 1 | 4 | 9.1 | CO/N=C(\CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL3609618 | 218611 | 0 | None | -1148 | 4 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
44334664 | 11312 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 625 | 6 | 0 | 5 | 4.3 | CC(=O)N1CCC2(CC1)C1C(=O)N(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)C1CN2C(=O)COCc1ccccc1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL102356 | 11312 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 625 | 6 | 0 | 5 | 4.3 | CC(=O)N1CCC2(CC1)C1C(=O)N(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)C1CN2C(=O)COCc1ccccc1 | 10.1016/s0960-894x(02)00659-5 | |||
86274488 | 167496 | 0 | None | -1584 | 2 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 372 | 3 | 0 | 7 | 2.7 | CCc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3C)n1 | nan | |||
CHEMBL4113741 | 167496 | 0 | None | -1584 | 2 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 372 | 3 | 0 | 7 | 2.7 | CCc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3C)n1 | nan | |||
44380093 | 127514 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 733 | 13 | 2 | 6 | 7.8 | CNC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354892 | 127514 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 733 | 13 | 2 | 6 | 7.8 | CNC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10010039 | 46679 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 711 | 14 | 2 | 6 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CNC2(CO)CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL147769 | 46679 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 711 | 14 | 2 | 6 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CNC2(CO)CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44305793 | 107622 | 0 | None | 5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 662 | 10 | 2 | 5 | 8.5 | O/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL293432 | 107622 | 0 | None | 5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 662 | 10 | 2 | 5 | 8.5 | O/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
44314577 | 166659 | 0 | None | 16 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 782 | 14 | 0 | 8 | 7.1 | CCOC(=O)C1CCN(C(=O)CN2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL41068 | 166659 | 0 | None | 16 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 782 | 14 | 0 | 8 | 7.1 | CCOC(=O)C1CCN(C(=O)CN2CCN(CCC(/C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/s0960-894x(00)00464-9 | |||
44314299 | 211924 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 739 | 13 | 1 | 7 | 5.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC[C@H]2C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL78070 | 211924 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 739 | 13 | 1 | 7 | 5.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC[C@H]2C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44318269 | 212769 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 543 | 3 | 1 | 5 | 4.2 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(Cc1ccc3c(c1)OCO3)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL84761 | 212769 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 543 | 3 | 1 | 5 | 4.2 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(Cc1ccc3c(c1)OCO3)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
44380474 | 65557 | 0 | None | 13 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 678 | 12 | 2 | 5 | 8.2 | CONC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168769 | 65557 | 0 | None | 13 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 678 | 12 | 2 | 5 | 8.2 | CONC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10417108 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL287454 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44314482 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL309087 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44380795 | 212911 | 0 | None | 7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 734 | 13 | 1 | 7 | 8.3 | COC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL85980 | 212911 | 0 | None | 7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 734 | 13 | 1 | 7 | 8.3 | COC(=O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44337313 | 115380 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL320487 | 115380 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 592 | 7 | 1 | 4 | 5.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44314482 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL309087 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363963 | 128055 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 724 | 13 | 1 | 6 | 7.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(C(N)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL357853 | 128055 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 724 | 13 | 1 | 6 | 7.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(C(N)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
10417108 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL287454 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
44314482 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL309087 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
44314482 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL309087 | 110586 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
10417108 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL287454 | 106876 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44338532 | 14402 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 324 | 6 | 1 | 3 | 3.5 | Cc1cc(C)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL108822 | 14402 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 324 | 6 | 1 | 3 | 3.5 | Cc1cc(C)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
9801487 | 213777 | 0 | None | 5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1021/jm058225d | |||
CHEMBL91418 | 213777 | 0 | None | 5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 406 | 5 | 1 | 3 | 4.8 | Cc1cc(C)cc(OCC(=O)N(c2ccc(Cl)c(Cl)c2)C2CCNCC2)c1 | 10.1021/jm058225d | |||
10603383 | 118124 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1c(Cl)cccc1Cl | 10.1021/jm970499g | |||
CHEMBL326893 | 118124 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1c(Cl)cccc1Cl | 10.1021/jm970499g | |||
73345476 | 96186 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 800 | 9 | 7 | 8 | 1.0 | CCC(C)Cc1cc(CC2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1OC | 10.1021/jm00029a007 | |||
CHEMBL2370514 | 96186 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 800 | 9 | 7 | 8 | 1.0 | CCC(C)Cc1cc(CC2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1OC | 10.1021/jm00029a007 | |||
45379601 | 207520 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 317 | 7 | 3 | 4 | 0.8 | NC(=O)[C@H](Cc1cccs1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL600224 | 207520 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 317 | 7 | 3 | 4 | 0.8 | NC(=O)[C@H](Cc1cccs1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
73212518 | 111377 | 0 | None | 39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 4.2 | CNCCNC(=O)[C@@H](NC(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104774 | 111377 | 0 | None | 39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 489 | 8 | 3 | 3 | 4.2 | CNCCNC(=O)[C@@H](NC(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
73212440 | 111382 | 0 | None | 39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 558 | 8 | 2 | 4 | 4.2 | CN1CCN(CCNC(=O)[C@@H](NC(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104780 | 111382 | 0 | None | 39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 558 | 8 | 2 | 4 | 4.2 | CN1CCN(CCNC(=O)[C@@H](NC(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/j.bmcl.2013.12.033 | |||
90644624 | 119538 | 0 | None | -6 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 669 | 10 | 3 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288163 | 119538 | 0 | None | -6 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 669 | 10 | 3 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305323 | 119538 | 0 | None | -6 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 669 | 10 | 3 | 6 | 5.3 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44358385 | 34236 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 702 | 13 | 0 | 6 | 8.4 | COc1cc(CN2CCN(C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc3)C(Cc3ccccc3)C2)cc(OC)c1OC | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136850 | 34236 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 702 | 13 | 0 | 6 | 8.4 | COc1cc(CN2CCN(C(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc3)C(Cc3ccccc3)C2)cc(OC)c1OC | 10.1016/s0960-894x(02)00956-3 | |||
73212593 | 111379 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 502 | 5 | 1 | 3 | 4.7 | CC(C)(C(=O)N[C@@H](C(=O)N1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104776 | 111379 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 502 | 5 | 1 | 3 | 4.7 | CC(C)(C(=O)N[C@@H](C(=O)N1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
73212592 | 111383 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 545 | 8 | 2 | 4 | 4.3 | CC(C)(C(=O)N[C@@H](C(=O)NCCN1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104781 | 111383 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 545 | 8 | 2 | 4 | 4.3 | CC(C)(C(=O)N[C@@H](C(=O)NCCN1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
145948981 | 174270 | 0 | None | -9 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1139 | 22 | 9 | 9 | 6.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299483 | 174270 | 0 | None | -9 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1139 | 22 | 9 | 9 | 6.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
73353535 | 97840 | 0 | None | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.2 | C[C@@](Cc1ccccc1)(NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397485 | 97840 | 0 | None | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.2 | C[C@@](Cc1ccccc1)(NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44281778 | 116473 | 0 | None | -4 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 608 | 11 | 1 | 5 | 8.0 | CO/N=C(\COCc1cc(Cl)cc(Cl)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32279 | 116473 | 0 | None | -4 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 608 | 11 | 1 | 5 | 8.0 | CO/N=C(\COCc1cc(Cl)cc(Cl)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
10794699 | 16009 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 684 | 9 | 2 | 3 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL110688 | 16009 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 684 | 9 | 2 | 3 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
10530592 | 17316 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 544 | 10 | 2 | 4 | 4.3 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL1169523 | 17316 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 544 | 10 | 2 | 4 | 4.3 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
44334591 | 114198 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 667 | 4 | 0 | 5 | 4.9 | CS(=O)(=O)N1CCC2(CC1)C1C(=O)N(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)C1CN2C(=O)c1ccc2ccccc2c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL318093 | 114198 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 667 | 4 | 0 | 5 | 4.9 | CS(=O)(=O)N1CCC2(CC1)C1C(=O)N(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)C1CN2C(=O)c1ccc2ccccc2c1 | 10.1016/s0960-894x(02)00659-5 | |||
10627789 | 107354 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 630 | 18 | 3 | 7 | 5.3 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1O | 10.1021/jm0205088 | |||
CHEMBL29161 | 107354 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 630 | 18 | 3 | 7 | 5.3 | CC(=O)NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1O | 10.1021/jm0205088 | |||
52937271 | 69295 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL1782139 | 69295 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
52937271 | 69295 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
CHEMBL1782139 | 69295 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 5 | 1 | 3 | 3.8 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
145948797 | 174255 | 0 | None | -26 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1105 | 22 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299390 | 174255 | 0 | None | -26 | 4 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1105 | 22 | 9 | 9 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
10603365 | 16061 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1C(F)(F)F | 10.1021/jm970499g | |||
CHEMBL110913 | 16061 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 2 | 3 | 5.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1C(F)(F)F | 10.1021/jm970499g | |||
CHEMBL261608 | 217298 | 0 | None | -9 | 3 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 | 10.1021/jm070332f | |||||
44337023 | 115451 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 861 | 11 | 0 | 7 | 8.2 | O=C(CN(N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL320770 | 115451 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 861 | 11 | 0 | 7 | 8.2 | O=C(CN(N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44462338 | 212575 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCOC23CC[C@@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL83156 | 212575 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCOC23CC[C@@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
145948847 | 174259 | 0 | None | -28 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1123 | 22 | 9 | 9 | 5.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299423 | 174259 | 0 | None | -28 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1123 | 22 | 9 | 9 | 5.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
10722607 | 11977 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 624 | 10 | 2 | 3 | 6.6 | CN(Cc1ccccc1)C(=O)[C@@H](NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl)C(c1ccccc1)c1ccccc1 | 10.1021/jm970499g | |||
CHEMBL106106 | 11977 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 624 | 10 | 2 | 3 | 6.6 | CN(Cc1ccccc1)C(=O)[C@@H](NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl)C(c1ccccc1)c1ccccc1 | 10.1021/jm970499g | |||
10698708 | 116567 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Br | 10.1021/jm970499g | |||
CHEMBL323274 | 116567 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Br | 10.1021/jm970499g | |||
10697884 | 171246 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 5.0 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL421408 | 171246 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 5.0 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
44408625 | 175501 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 465 | 4 | 0 | 1 | 7.4 | CN(C(=O)c1ccccc1-c1ccccc1)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL436951 | 175501 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 465 | 4 | 0 | 1 | 7.4 | CN(C(=O)c1ccccc1-c1ccccc1)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44315590 | 174587 | 0 | None | 1 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 774 | 14 | 1 | 8 | 7.5 | CCNC(=O)Cn1c(=O)n(C2CCN(CC[C@@H](/C(CN(CC)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL430609 | 174587 | 0 | None | 1 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 774 | 14 | 1 | 8 | 7.5 | CCNC(=O)Cn1c(=O)n(C2CCN(CC[C@@H](/C(CN(CC)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL2371978 | 216951 | 0 | None | 30 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm061369n | |||||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10.1021/jm2017072 | |||
9918520 | 109528 | 0 | None | 2 | 2 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL305055 | 109528 | 0 | None | 2 | 2 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 753 | 12 | 1 | 7 | 5.8 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCC(CC(=O)N3CC(O)C3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
46889466 | 14050 | 1 | None | 30 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 573 | 8 | 1 | 4 | 7.4 | COCCNc1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1086004 | 14050 | 1 | None | 30 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 573 | 8 | 1 | 4 | 7.4 | COCCNc1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
104943 | 62160 | 39 | None | 1862 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00020-8 | |||
CHEMBL16192 | 62160 | 39 | None | 1862 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 5.1 | COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00020-8 | |||
44408100 | 147464 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 474 | 6 | 1 | 2 | 6.1 | CC(C)N1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL381524 | 147464 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 474 | 6 | 1 | 2 | 6.1 | CC(C)N1C[C@@](CO[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)NC1=O | 10.1016/j.bmcl.2005.10.072 | |||
44407972 | 147534 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 653 | 9 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381825 | 147534 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 653 | 9 | 1 | 6 | 5.7 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44338583 | 12568 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 5.2 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1F | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL107875 | 12568 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 468 | 6 | 1 | 3 | 5.2 | Fc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1F | 10.1016/s0960-894x(02)00956-3 | |||
44358280 | 33651 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 446 | 6 | 1 | 3 | 5.2 | Cc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136360 | 33651 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 446 | 6 | 1 | 3 | 5.2 | Cc1cccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358334 | 33812 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136504 | 33812 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 4.2 | Clc1cc(Cl)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44358569 | 123570 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 533 | 11 | 1 | 5 | 4.1 | NC(=O)COCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL337789 | 123570 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 533 | 11 | 1 | 5 | 4.1 | NC(=O)COCCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358323 | 125757 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.2 | C[C@H](OC[C@@H](c1ccccc1)N1CCN(CC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL342443 | 125757 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.2 | C[C@H](OC[C@@H](c1ccccc1)N1CCN(CC(=O)O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44315573 | 110573 | 0 | None | 1 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 707 | 12 | 1 | 7 | 8.3 | CO/N=C(\CN(CCF)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
CHEMBL308983 | 110573 | 0 | None | 1 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 707 | 12 | 1 | 7 | 8.3 | CO/N=C(\CN(CCF)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00462-6 | |||
44337371 | 12063 | 0 | None | 4 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 720 | 7 | 1 | 4 | 6.8 | O=C(c1cc(Br)cc(Br)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106572 | 12063 | 0 | None | 4 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 720 | 7 | 1 | 4 | 6.8 | O=C(c1cc(Br)cc(Br)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
25129135 | 179376 | 0 | None | -7 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
CHEMBL448998 | 179376 | 0 | None | -7 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
9918479 | 64386 | 0 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 748 | 14 | 1 | 7 | 6.7 | CN(C/C(=N\OCCCS(=O)(=O)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166827 | 64386 | 0 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 748 | 14 | 1 | 7 | 6.7 | CN(C/C(=N\OCCCS(=O)(=O)O)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
22000062 | 83333 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1cnccc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206268 | 83333 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1cnccc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
145948809 | 174257 | 0 | None | 1 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1231 | 22 | 9 | 9 | 5.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299402 | 174257 | 0 | None | 1 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1231 | 22 | 9 | 9 | 5.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44611294 | 97849 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 329 | 7 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397494 | 97849 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 329 | 7 | 3 | 3 | 0.9 | NC(=O)[C@H](Cc1cccc(F)c1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
10239000 | 86556 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 488 | 6 | 1 | 3 | 5.3 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N(C)C)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
CHEMBL211888 | 86556 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 488 | 6 | 1 | 3 | 5.3 | C[C@@H](OC[C@]1(c2ccccc2)C[C@](N)(C(=O)N(C)C)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2006.04.031 | |||
11467400 | 13278 | 0 | None | 3 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 587 | 8 | 1 | 4 | 7.2 | CCN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
CHEMBL1082735 | 13278 | 0 | None | 3 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 587 | 8 | 1 | 4 | 7.2 | CCN(CCO)c1cc(-c2ccccc2Cl)c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 | 10.1016/j.bmcl.2010.04.008 | |||
9869764 | 147320 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1ccncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL381058 | 147320 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1ccncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
145948955 | 174266 | 0 | None | 7 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299466 | 174266 | 0 | None | 7 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44409008 | 81891 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 551 | 5 | 0 | 5 | 5.5 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)nc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL203605 | 81891 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 551 | 5 | 0 | 5 | 5.5 | Cc1ccccc1-c1cnc(N2CCN(C)CC2)nc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
10530741 | 15965 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1F | 10.1021/jm970499g | |||
CHEMBL110355 | 15965 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 552 | 8 | 2 | 3 | 5.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1F | 10.1021/jm970499g | |||
10115747 | 147934 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 464 | 5 | 1 | 2 | 5.5 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CN(C)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL382771 | 147934 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 464 | 5 | 1 | 2 | 5.5 | C[C@@H](OC[C@@]1(c2ccc(F)cc2)CN(C)C(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL2419540 | 217220 | 0 | None | -4 | 4 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
46227360 | 209361 | 0 | None | 1 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611924 | 209361 | 0 | None | 1 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44138555 | 199951 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL523156 | 199951 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
44408766 | 103699 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1cccnc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL265986 | 103699 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1cccnc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
10507650 | 170109 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 591 | 9 | 3 | 4 | 4.6 | CNC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL419004 | 170109 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 591 | 9 | 3 | 4 | 4.6 | CNC(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
90644635 | 119483 | 0 | None | 6 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 711 | 12 | 2 | 6 | 5.9 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288170 | 119483 | 0 | None | 6 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 711 | 12 | 2 | 6 | 5.9 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3304460 | 119483 | 0 | None | 6 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 711 | 12 | 2 | 6 | 5.9 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)NCCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44408033 | 81547 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 5.6 | CO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL203111 | 81547 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 5.6 | CO/N=C(/C)CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1 | 10.1016/j.bmcl.2005.10.077 | |||
44337414 | 15987 | 0 | None | 5 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 889 | 13 | 2 | 7 | 9.1 | O=C(CN(NC1CCN(Cc2ccccc2)CC1)NC1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL110507 | 15987 | 0 | None | 5 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 889 | 13 | 2 | 7 | 9.1 | O=C(CN(NC1CCN(Cc2ccccc2)CC1)NC1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
46227362 | 209363 | 0 | None | -301 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611926 | 209363 | 0 | None | -301 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
44314154 | 211846 | 0 | None | 24 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 585 | 10 | 1 | 5 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCNCC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL77265 | 211846 | 0 | None | 24 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 585 | 10 | 1 | 5 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCNCC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44334845 | 115684 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 725 | 6 | 0 | 7 | 5.2 | COc1ccc(OC)c(S(=O)(=O)N2CCC3(CC2)C2C(=O)N(c4ccccc4)C(=O)C2CN3C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL321098 | 115684 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 725 | 6 | 0 | 7 | 5.2 | COc1ccc(OC)c(S(=O)(=O)N2CCC3(CC2)C2C(=O)N(c4ccccc4)C(=O)C2CN3C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 | 10.1016/s0960-894x(02)00659-5 | |||
3668 | 8342 | 42 | None | -38 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
5311081 | 8342 | 42 | None | -38 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
CHEMBL333357 | 8342 | 42 | None | -38 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
CHEMBL589982 | 8342 | 42 | None | -38 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
44334666 | 11399 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 736 | 4 | 1 | 7 | 4.5 | O=C1COc2ccc(S(=O)(=O)N3CCC4(CC3)C3C(=O)N(c5ccccc5)C(=O)C3CN4C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL102917 | 11399 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 736 | 4 | 1 | 7 | 4.5 | O=C1COc2ccc(S(=O)(=O)N3CCC4(CC3)C3C(=O)N(c5ccccc5)C(=O)C3CN4C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2N1 | 10.1016/s0960-894x(02)00659-5 | |||
90663661 | 113488 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 1140 | 33 | 10 | 15 | -0.0 | CCCN1C(=O)C2NC(c3ccc(OCC(=O)NCCNC(=O)C(N)CC(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](Cc4ccccc4)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O)cc3)=NC2N(CCC)C1=O | 10.1021/jm00391a046 | |||
CHEMBL3143946 | 113488 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 1140 | 33 | 10 | 15 | -0.0 | CCCN1C(=O)C2NC(c3ccc(OCC(=O)NCCNC(=O)C(N)CC(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](Cc4ccccc4)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O)cc3)=NC2N(CCC)C1=O | 10.1021/jm00391a046 | |||
118730935 | 124937 | 0 | None | -10715 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 699 | 15 | 6 | 7 | 1.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408521 | 124937 | 0 | None | -10715 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 699 | 15 | 6 | 7 | 1.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44334708 | 11405 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 609 | 2 | 0 | 4 | 5.4 | CC(C)(C)C(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL102932 | 11405 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 609 | 2 | 0 | 4 | 5.4 | CC(C)(C)C(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
118731117 | 124951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 740 | 17 | 7 | 7 | 2.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(Cc2ccccc2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408734 | 124951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 740 | 17 | 7 | 7 | 2.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(Cc2ccccc2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
56682292 | 72684 | 0 | None | 12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 808 | 15 | 2 | 6 | 7.7 | O=C(COCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
CHEMBL1835845 | 72684 | 0 | None | 12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 808 | 15 | 2 | 6 | 7.7 | O=C(COCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
90644631 | 118722 | 0 | None | -12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 684 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCO)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288167 | 118722 | 0 | None | -12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 684 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCO)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44358248 | 33446 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 484 | 8 | 1 | 3 | 6.2 | C=Cc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1C=C | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136187 | 33446 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 484 | 8 | 1 | 3 | 6.2 | C=Cc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1C=C | 10.1016/s0960-894x(02)00956-3 | |||
20599018 | 206182 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 517 | 2 | 1 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL591075 | 206182 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 517 | 2 | 1 | 2 | 6.5 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
44304398 | 109463 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 459 | 2 | 1 | 2 | 5.3 | CC1c2ccccc2NC(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL304638 | 109463 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 459 | 2 | 1 | 2 | 5.3 | CC1c2ccccc2NC(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
16655023 | 114218 | 2 | None | -251 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 481 | 7 | 0 | 7 | 3.7 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 | 10.1016/j.bmc.2007.03.053 | |||
CHEMBL318235 | 114218 | 2 | None | -251 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 481 | 7 | 0 | 7 | 3.7 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 | 10.1016/j.bmc.2007.03.053 | |||
44408911 | 147341 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 355 | 4 | 1 | 3 | 5.8 | Cc1ccccc1-c1ccccc1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL381179 | 147341 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 355 | 4 | 1 | 3 | 5.8 | Cc1ccccc1-c1ccccc1/C=N/Nc1c(Cl)cncc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
73212517 | 111378 | 0 | None | 31 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 475 | 7 | 3 | 3 | 3.9 | CC(C)(C(=O)N[C@H](C(=O)NCCN)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104775 | 111378 | 0 | None | 31 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 475 | 7 | 3 | 3 | 3.9 | CC(C)(C(=O)N[C@H](C(=O)NCCN)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
73212516 | 111380 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 502 | 5 | 1 | 3 | 4.7 | CC(C)(C(=O)N[C@H](C(=O)N1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104777 | 111380 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 502 | 5 | 1 | 3 | 4.7 | CC(C)(C(=O)N[C@H](C(=O)N1CCOCC1)c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.12.033 | |||
90644626 | 119530 | 0 | None | 2 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288164 | 119530 | 0 | None | 2 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305163 | 119530 | 0 | None | 2 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44304340 | 209649 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 503 | 3 | 1 | 4 | 4.4 | COC(=O)C1c2ccccc2NC(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL62597 | 209649 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 503 | 3 | 1 | 4 | 4.4 | COC(=O)C1c2ccccc2NC(=O)CN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
44337270 | 115379 | 0 | None | -4 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 665 | 8 | 3 | 6 | 4.5 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4ccc(O)cc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL320486 | 115379 | 0 | None | -4 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 665 | 8 | 3 | 6 | 4.5 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4ccc(O)cc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44337007 | 117185 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 863 | 9 | 2 | 7 | 8.5 | O=C(CN(N1CCC(O)(c2ccccc2)CC1)N1CCC(O)(c2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL324416 | 117185 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 863 | 9 | 2 | 7 | 8.5 | O=C(CN(N1CCC(O)(c2ccccc2)CC1)N1CCC(O)(c2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00645-5 | |||
52937273 | 69293 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 458 | 3 | 0 | 2 | 4.7 | CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | |||
CHEMBL1782137 | 69293 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 458 | 3 | 0 | 2 | 4.7 | CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm1016285 | |||
44281572 | 117169 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 705 | 10 | 2 | 6 | 8.7 | CO/N=C(\COC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32431 | 117169 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 705 | 10 | 2 | 6 | 8.7 | CO/N=C(\COC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281776 | 121029 | 0 | None | -3 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 568 | 11 | 1 | 5 | 7.3 | CO/N=C(\COCc1cc(C)cc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33302 | 121029 | 0 | None | -3 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 568 | 11 | 1 | 5 | 7.3 | CO/N=C(\COCc1cc(C)cc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
54581461 | 68037 | 0 | None | -2089 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
CHEMBL1766207 | 68037 | 0 | None | -2089 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 1143 | 29 | 10 | 12 | 4.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(OC)c(OC)c1 | 10.1021/jm101023r | |||
86275687 | 150419 | 0 | None | -776 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 374 | 2 | 0 | 7 | 3.0 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)cc2)C3C)n1 | nan | |||
CHEMBL3899877 | 150419 | 0 | None | -776 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 374 | 2 | 0 | 7 | 3.0 | Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccc(Cl)cc2)C3C)n1 | nan | |||
10007108 | 170744 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 527 | 2 | 1 | 3 | 5.4 | Cc1cc(C)c(C(=O)N2CCC3(CC2)NC(=O)N(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c(C)c1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL420787 | 170744 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 527 | 2 | 1 | 3 | 5.4 | Cc1cc(C)c(C(=O)N2CCC3(CC2)NC(=O)N(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c(C)c1 | 10.1016/s0960-894x(02)00488-2 | |||
44380475 | 65558 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 675 | 11 | 1 | 4 | 9.2 | CO/C=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168770 | 65558 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 675 | 11 | 1 | 4 | 9.2 | CO/C=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44314476 | 111859 | 0 | None | 12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL311387 | 111859 | 0 | None | 12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 676 | 11 | 1 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
24768355 | 175674 | 0 | None | -53 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL438389 | 175674 | 0 | None | -53 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
24768355 | 175674 | 0 | None | -53 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
CHEMBL438389 | 175674 | 0 | None | -53 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1077 | 22 | 9 | 9 | 4.7 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
44281713 | 106439 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 600 | 13 | 1 | 7 | 6.7 | CO/N=C(\COCc1cc(OC)cc(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL284396 | 106439 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 600 | 13 | 1 | 7 | 6.7 | CO/N=C(\COCc1cc(OC)cc(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281788 | 106762 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 583 | 11 | 2 | 6 | 5.9 | CO/N=C(\CNC(=O)c1ccccc1OC)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL286640 | 106762 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 583 | 11 | 2 | 6 | 5.9 | CO/N=C(\CNC(=O)c1ccccc1OC)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
73353536 | 97842 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 337 | 6 | 3 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1NCC[C@H]1c1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397487 | 97842 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 337 | 6 | 3 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1NCC[C@H]1c1ccccc1 | 10.1021/jm400209h | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1016/j.bmcl.2011.02.033 | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1016/j.bmcl.2011.02.033 | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1016/j.bmcl.2011.02.033 | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1016/j.bmcl.2011.02.033 | |||
10600014 | 174649 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 459 | 7 | 2 | 3 | 4.9 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1 | 10.1021/jm970499g | |||
CHEMBL431070 | 174649 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 459 | 7 | 2 | 3 | 4.9 | COc1ccccc1C/N=C(\S)N1CCC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1 | 10.1021/jm970499g | |||
10007326 | 113643 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 2 | 1 | 3 | 5.6 | O=C(c1cccc2ccccc12)N1CCC2(CC1)NC(=O)N(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL314499 | 113643 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 2 | 1 | 3 | 5.6 | O=C(c1cccc2ccccc12)N1CCC2(CC1)NC(=O)N(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
44314481 | 211715 | 0 | None | 10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 662 | 10 | 2 | 5 | 8.5 | O/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL76334 | 211715 | 0 | None | 10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 662 | 10 | 2 | 5 | 8.5 | O/N=C(/COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
145948839 | 174258 | 0 | None | -85 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1137 | 22 | 8 | 9 | 5.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299415 | 174258 | 0 | None | -85 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1137 | 22 | 8 | 9 | 5.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
145948968 | 174268 | 0 | None | -8 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1095 | 22 | 9 | 9 | 4.8 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299479 | 174268 | 0 | None | -8 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1095 | 22 | 9 | 9 | 4.8 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
45271306 | 202451 | 0 | None | -645 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL556537 | 202451 | 0 | None | -645 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1438 | 33 | 14 | 16 | 3.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO[C@@H]1O[C@H](CC)[C@@H](O)[C@H](O)[C@H]1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
118730934 | 124936 | 0 | None | -363 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 835 | 15 | 6 | 7 | 4.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408520 | 124936 | 0 | None | -363 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 835 | 15 | 6 | 7 | 4.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
51003494 | 65096 | 0 | None | -44 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 3.5 | CN(Cc1ccc(F)cc1)C(=O)[C@@]1(c2ccc(Cl)c(Cl)c2)C[C@H]1CN1CCN(S(=O)(=O)N(C)C)CC1 | 10.1016/j.bmcl.2010.12.135 | |||
CHEMBL1682680 | 65096 | 0 | None | -44 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 3.5 | CN(Cc1ccc(F)cc1)C(=O)[C@@]1(c2ccc(Cl)c(Cl)c2)C[C@H]1CN1CCN(S(=O)(=O)N(C)C)CC1 | 10.1016/j.bmcl.2010.12.135 | |||
44337355 | 12118 | 0 | None | -26 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 581 | 7 | 2 | 4 | 5.2 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4cc[nH]c4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106877 | 12118 | 0 | None | -26 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 581 | 7 | 2 | 4 | 5.2 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4cc[nH]c4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
118731114 | 124948 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 862 | 16 | 7 | 7 | 4.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408731 | 124948 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 862 | 16 | 7 | 7 | 4.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44363948 | 43151 | 0 | None | 5 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 653 | 11 | 0 | 5 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144668 | 43151 | 0 | None | 5 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 653 | 11 | 0 | 5 | 8.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44363912 | 125535 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 681 | 12 | 0 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL341843 | 125535 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 681 | 12 | 0 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
10507772 | 116530 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccc2ccccc2c1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL323044 | 116530 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 6.1 | CN(Cc1ccc2ccccc2c1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
44336987 | 115726 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 791 | 11 | 0 | 5 | 9.2 | O=C(CN(N1CCC(Cc2ccccc2)CC1)N1CCC(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL321154 | 115726 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 791 | 11 | 0 | 5 | 9.2 | O=C(CN(N1CCC(Cc2ccccc2)CC1)N1CCC(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
9809308 | 212503 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 624 | 6 | 0 | 4 | 5.4 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)CN3CCC(Cc4ccccc4)CC3)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL82552 | 212503 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 624 | 6 | 0 | 4 | 5.4 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)CN3CCC(Cc4ccccc4)CC3)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
4189 | 213701 | 96 | None | -27 | 34 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
CHEMBL1559 | 213701 | 96 | None | -27 | 34 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
CHEMBL91 | 213701 | 96 | None | -27 | 34 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | nan | |||
44408628 | 147141 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 409 | 5 | 1 | 1 | 6.7 | FC(F)(F)c1cc(CNCc2ccccc2-c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL380827 | 147141 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 409 | 5 | 1 | 1 | 6.7 | FC(F)(F)c1cc(CNCc2ccccc2-c2ccccc2)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44380764 | 127506 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 689 | 11 | 1 | 5 | 8.6 | CN(C)/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL354822 | 127506 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 689 | 11 | 1 | 5 | 8.6 | CN(C)/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44363978 | 47264 | 0 | None | 1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 7.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL148282 | 47264 | 0 | None | 1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 697 | 12 | 1 | 6 | 7.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
11801041 | 117231 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 562 | 9 | 1 | 3 | 5.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL324667 | 117231 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 562 | 9 | 1 | 3 | 5.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
44334654 | 114978 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 653 | 3 | 0 | 5 | 4.8 | CN1C(=O)C2CN(S(=O)(=O)c3ccc4ccccc4c3)C3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2C1=O | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL319653 | 114978 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 653 | 3 | 0 | 5 | 4.8 | CN1C(=O)C2CN(S(=O)(=O)c3ccc4ccccc4c3)C3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2C1=O | 10.1016/s0960-894x(02)00659-5 | |||
52937270 | 69294 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 501 | 5 | 2 | 3 | 3.4 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
CHEMBL1782138 | 69294 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 501 | 5 | 2 | 3 | 3.4 | CC(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/jm1016285 | |||
145948809 | 174257 | 0 | None | -11 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 1231 | 22 | 9 | 9 | 5.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299402 | 174257 | 0 | None | -11 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 1231 | 22 | 9 | 9 | 5.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44314945 | 211775 | 0 | None | 9 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 728 | 17 | 1 | 7 | 6.9 | CCOCCCNC(=O)CN1CCN(CCC(/C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)=N/OC)c2ccc(Cl)c(Cl)c2)CC1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL76727 | 211775 | 0 | None | 9 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 728 | 17 | 1 | 7 | 6.9 | CCOCCCNC(=O)CN1CCN(CCC(/C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)=N/OC)c2ccc(Cl)c(Cl)c2)CC1 | 10.1016/s0960-894x(00)00464-9 | |||
44281392 | 106734 | 0 | None | 3 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 690 | 12 | 1 | 5 | 8.8 | CO/N=C(\COCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL286433 | 106734 | 0 | None | 3 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 690 | 12 | 1 | 5 | 8.8 | CO/N=C(\COCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44323563 | 213793 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 322 | 4 | 2 | 3 | 3.4 | COc1ccccc1CN[C@H]1CCCN[C@]12CCc1ccccc12 | 10.1016/0960-894X(95)00481-8 | |||
CHEMBL91475 | 213793 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 322 | 4 | 2 | 3 | 3.4 | COc1ccccc1CN[C@H]1CCCN[C@]12CCc1ccccc12 | 10.1016/0960-894X(95)00481-8 | |||
90644629 | 118436 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 711 | 12 | 2 | 6 | 5.8 | CN(C)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
CHEMBL3286415 | 118436 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 711 | 12 | 2 | 6 | 5.8 | CN(C)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@](C)(CCN1CCC2(CC1)OC(=O)N(C)c1ccc(F)cc12)c1ccc(Cl)c(Cl)c1 | 10.1021/ml400528y | |||
10300825 | 36716 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 504 | 8 | 0 | 5 | 4.8 | COC(=O)CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138839 | 36716 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 504 | 8 | 0 | 5 | 4.8 | COC(=O)CN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44304301 | 210096 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 445 | 2 | 1 | 2 | 5.8 | CC1c2ccccc2NCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL64839 | 210096 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 445 | 2 | 1 | 2 | 5.8 | CC1c2ccccc2NCCN1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL5286117 | 201111 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 484 | 3 | 1 | 3 | 5.2 | CC(=O)N1Cc2[nH]c3ccccc3c2C[C@H]1C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.6b01029 | |||
90644616 | 119513 | 0 | None | 25 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288159 | 119513 | 0 | None | 25 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3304856 | 119513 | 0 | None | 25 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
90644610 | 119526 | 0 | None | 15 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288156 | 119526 | 0 | None | 15 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305158 | 119526 | 0 | None | 15 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm5017413 | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm5017413 | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm5017413 | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm5017413 | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 10.1021/jm5017413 | |||
44338557 | 16120 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 330 | 6 | 1 | 3 | 3.5 | Clc1cccc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL111244 | 16120 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 330 | 6 | 1 | 3 | 3.5 | Clc1cccc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44363926 | 45843 | 0 | None | 3 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 669 | 11 | 1 | 6 | 7.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL146882 | 45843 | 0 | None | 3 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 669 | 11 | 1 | 6 | 7.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCC(O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44314867 | 164106 | 0 | None | 8 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL407749 | 164106 | 0 | None | 8 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CNC(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
44408755 | 81813 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1cccnc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL203481 | 81813 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 480 | 4 | 0 | 2 | 7.0 | Cc1ccccc1-c1cccnc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
10032693 | 116539 | 0 | None | 2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 703 | 10 | 1 | 5 | 8.3 | CO/N=C(\CN(C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32309 | 116539 | 0 | None | 2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 703 | 10 | 1 | 5 | 8.3 | CO/N=C(\CN(C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
107686 | 10152 | 41 | None | 15 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | |||
3522 | 10152 | 41 | None | 15 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | |||
CHEMBL131171 | 10152 | 41 | None | 15 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.1 | COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80650-2 | |||
9939040 | 11782 | 7 | None | 2 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
CHEMBL105060 | 11782 | 7 | None | 2 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
CHEMBL2419544 | 217224 | 0 | None | -14 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
10602943 | 114195 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C#N)c1 | 10.1021/jm970499g | |||
CHEMBL318084 | 114195 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 559 | 8 | 2 | 4 | 5.1 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C#N)c1 | 10.1021/jm970499g | |||
9824321 | 82217 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204206 | 82217 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NCC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
9846661 | 83350 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1cnccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206294 | 83350 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1cnccc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
44380457 | 64890 | 0 | None | 3 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 698 | 12 | 0 | 7 | 6.6 | COC(=O)CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL167613 | 64890 | 0 | None | 3 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 698 | 12 | 0 | 7 | 6.6 | COC(=O)CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
9939307 | 210265 | 0 | None | -2 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL66106 | 210265 | 0 | None | -2 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10531666 | 15963 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 601 | 9 | 2 | 4 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cn(C)c2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL110340 | 15963 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 601 | 9 | 2 | 4 | 5.5 | CN(Cc1ccccc1)C(=O)[C@H](Cc1cn(C)c2ccccc12)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL3609615 | 218608 | 0 | None | -24 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | None | None | None | C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||||
44318312 | 111643 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCOC23CC[C@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
CHEMBL311027 | 111643 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 2 | 1 | 3 | 4.8 | Fc1ccc([C@@H]2NCCOC23CC[C@H](c2ccccc2C(F)(F)F)CO3)cc1 | 10.1016/s0960-894x(02)00506-1 | |||
86275451 | 166872 | 0 | None | -5623 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 420 | 4 | 0 | 8 | 3.8 | CCc1noc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | nan | |||
CHEMBL4108623 | 166872 | 0 | None | -5623 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 420 | 4 | 0 | 8 | 3.8 | CCc1noc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)n1 | nan | |||
57396389 | 75143 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 734 | 14 | 4 | 6 | 6.4 | CC(C)C[C@H](NC(=O)CNC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.ejmech.2011.08.042 | |||
CHEMBL1916636 | 75143 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 734 | 14 | 4 | 6 | 6.4 | CC(C)C[C@H](NC(=O)CNC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.ejmech.2011.08.042 | |||
44407890 | 81949 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL203655 | 81949 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@@H](OC[C@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
44337208 | 12011 | 0 | None | -38 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 635 | 7 | 2 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@@H](N)c4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106300 | 12011 | 0 | None | -38 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 635 | 7 | 2 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@@H](N)c4ccccc4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44282003 | 106887 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 689 | 11 | 1 | 5 | 8.6 | CO/N=C(\CN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL287523 | 106887 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 689 | 11 | 1 | 5 | 8.6 | CO/N=C(\CN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44334500 | 11308 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 599 | 5 | 1 | 6 | 4.1 | COc1ccc(C(=O)N2CC3C(=O)N(Cc4cc(C(F)(F)F)cc(C(F)(F)F)c4)C(=O)C3C23CCNCC3)cc1OC | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL102332 | 11308 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 599 | 5 | 1 | 6 | 4.1 | COc1ccc(C(=O)N2CC3C(=O)N(Cc4cc(C(F)(F)F)cc(C(F)(F)F)c4)C(=O)C3C23CCNCC3)cc1OC | 10.1016/s0960-894x(02)00659-5 | |||
44281744 | 120251 | 0 | None | -1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 739 | 11 | 1 | 6 | 7.8 | CO/N=C(\CN(C)S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33194 | 120251 | 0 | None | -1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 739 | 11 | 1 | 6 | 7.8 | CO/N=C(\CN(C)S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44363877 | 45924 | 0 | None | 3 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 709 | 12 | 1 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL146947 | 45924 | 0 | None | 3 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 709 | 12 | 1 | 5 | 8.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44409004 | 81214 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 515 | 4 | 0 | 1 | 7.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1Br | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL202720 | 81214 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 515 | 4 | 0 | 1 | 7.4 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1Br | 10.1016/j.bmcl.2005.11.047 | |||
46227361 | 209362 | 0 | None | -85 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611925 | 209362 | 0 | None | -85 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44318565 | 212708 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 528 | 3 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N2CCC3(CC2)NC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL84161 | 212708 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 528 | 3 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N2CCC3(CC2)NC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)c1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL2372339 | 217001 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(N)=O)C(N)=O | 10.1021/jm00391a046 | |||||
44318497 | 212779 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 563 | 3 | 0 | 3 | 5.9 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3cccc4ccccc34)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL84873 | 212779 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 563 | 3 | 0 | 3 | 5.9 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3cccc4ccccc34)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
145948965 | 174267 | 0 | None | -18 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1183 | 22 | 9 | 9 | 6.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299476 | 174267 | 0 | None | -18 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1183 | 22 | 9 | 9 | 6.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44314872 | 103647 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 740 | 13 | 1 | 7 | 6.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL265499 | 103647 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 740 | 13 | 1 | 7 | 6.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCCC2CO)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44337202 | 14747 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)[C@H](c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL109053 | 14747 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)[C@H](c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
44337079 | 113973 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 877 | 11 | 2 | 7 | 7.5 | CC(=O)NC1(c2ccccc2)CCN(N(CC(=O)N2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2c2ccccc2)N2CCC(NC(C)=O)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL316553 | 113973 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 877 | 11 | 2 | 7 | 7.5 | CC(=O)NC1(c2ccccc2)CCN(N(CC(=O)N2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2c2ccccc2)N2CCC(NC(C)=O)(c3ccccc3)CC2)CC1 | 10.1016/s0960-894x(02)00645-5 | |||
44337024 | 115453 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 793 | 11 | 0 | 7 | 6.9 | O=C(CN(N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL320771 | 115453 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 793 | 11 | 0 | 7 | 6.9 | O=C(CN(N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2ccccc2)CC1)N1CCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1c1ccccc1 | 10.1016/s0960-894x(02)00645-5 | |||
145948744 | 174254 | 0 | None | -47 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299371 | 174254 | 0 | None | -47 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1120 | 22 | 8 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
10769914 | 117927 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 601 | 10 | 3 | 3 | 5.5 | CN(CCc1c[nH]c2ccccc12)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL326429 | 117927 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 601 | 10 | 3 | 3 | 5.5 | CN(CCc1c[nH]c2ccccc12)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL2112592 | 216019 | 0 | None | -1 | 2 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](Cc2ccc(OC(C)(C)C)cc2)NC(=O)CNC1=O | 10.1021/jm00029a007 | |||||
44380596 | 66126 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 706 | 13 | 1 | 6 | 8.7 | COCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL170727 | 66126 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 706 | 13 | 1 | 6 | 8.7 | COCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44408726 | 83335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 419 | 4 | 1 | 3 | 6.3 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1ccccc1Br | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL206274 | 83335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 419 | 4 | 1 | 3 | 6.3 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1ccccc1Br | 10.1016/j.bmcl.2005.11.047 | |||
10091563 | 46484 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 386 | 7 | 2 | 3 | 4.7 | COc1ccccc1CN[C@H]1CCCN[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
CHEMBL147543 | 46484 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 386 | 7 | 2 | 3 | 4.7 | COc1ccccc1CN[C@H]1CCCN[C@H]1C(c1ccccc1)c1ccccc1 | 10.1021/jm00104a018 | |||
44314861 | 174559 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL430416 | 174559 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
11801965 | 11992 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 616 | 9 | 2 | 3 | 6.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL106217 | 11992 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 616 | 9 | 2 | 3 | 6.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
10603279 | 14794 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C(N)=O)c1 | 10.1021/jm970499g | |||
CHEMBL109080 | 14794 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 577 | 9 | 3 | 4 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(C(N)=O)c1 | 10.1021/jm970499g | |||
9939307 | 210265 | 0 | None | -3 | 4 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
CHEMBL66106 | 210265 | 0 | None | -3 | 4 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 640 | 10 | 0 | 5 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00340-2 | |||
44282001 | 106584 | 0 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 705 | 12 | 1 | 7 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(OC)c(Br)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL285422 | 106584 | 0 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 705 | 12 | 1 | 7 | 7.0 | CO/N=C(\CN(C)C(=O)c1cc(OC)c(Br)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281571 | 117166 | 0 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 718 | 10 | 2 | 5 | 8.7 | CO/N=C(\CN(C)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32430 | 117166 | 0 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 718 | 10 | 2 | 5 | 8.7 | CO/N=C(\CN(C)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44281976 | 117351 | 0 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 627 | 12 | 1 | 7 | 6.2 | CO/N=C(\CN(C)C(=O)c1cc(OC)cc(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32537 | 117351 | 0 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 627 | 12 | 1 | 7 | 6.2 | CO/N=C(\CN(C)C(=O)c1cc(OC)cc(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
10321715 | 33478 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136213 | 33478 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 452 | 6 | 1 | 3 | 4.4 | Brc1cc(Br)cc(COCC(c2ccccc2)N2CCNCC2)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44338618 | 116103 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL321892 | 116103 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
10393853 | 116489 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 603 | 3 | 0 | 5 | 3.8 | CS(=O)(=O)N1CC2C(=O)N(c3ccccc3)C(=O)C2C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL322885 | 116489 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 603 | 3 | 0 | 5 | 3.8 | CS(=O)(=O)N1CC2C(=O)N(c3ccccc3)C(=O)C2C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2 | 10.1016/s0960-894x(02)00659-5 | |||
2755911 | 82214 | 52 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL2042018 | 82214 | 52 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
2755911 | 82214 | 52 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
CHEMBL2042018 | 82214 | 52 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1021/ml5002954 | |||
2755911 | 82214 | 52 | None | -1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
CHEMBL2042018 | 82214 | 52 | None | -1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 298 | 6 | 2 | 3 | 2.0 | NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 | 10.1016/j.bmcl.2018.06.009 | |||
15887537 | 115823 | 0 | None | 3 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL321270 | 115823 | 0 | None | 3 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 700 | 7 | 1 | 4 | 7.3 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
145948968 | 174268 | 0 | None | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 1095 | 22 | 9 | 9 | 4.8 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299479 | 174268 | 0 | None | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 1095 | 22 | 9 | 9 | 4.8 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44364030 | 43421 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 711 | 13 | 1 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL144887 | 43421 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 711 | 13 | 1 | 6 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CO)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44282004 | 128539 | 0 | None | 2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 675 | 11 | 2 | 5 | 8.3 | CO/N=C(\CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL35891 | 128539 | 0 | None | 2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 675 | 11 | 2 | 5 | 8.3 | CO/N=C(\CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
90644608 | 119484 | 0 | None | 79 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288155 | 119484 | 0 | None | 79 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3304468 | 119484 | 0 | None | 79 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 697 | 12 | 2 | 6 | 5.7 | CN1C(=O)OC2(CCN(CCC[C@@H](C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44338652 | 115387 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL320544 | 115387 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00956-3 | |||
46224897 | 205891 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 475 | 3 | 1 | 2 | 5.1 | Cc1cc(F)ccc1C1CNCC2CN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)N21 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL589130 | 205891 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 475 | 3 | 1 | 2 | 5.1 | Cc1cc(F)ccc1C1CNCC2CN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C(=O)N21 | 10.1016/j.bmcl.2009.11.078 | |||
73350555 | 97843 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 337 | 6 | 3 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1NCC[C@@H]1c1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397488 | 97843 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 337 | 6 | 3 | 3 | 1.3 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1NCC[C@@H]1c1ccccc1 | 10.1021/jm400209h | |||
2098 | 10466 | 36 | None | -2 | 6 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00073a022 | |||||
36511 | 10466 | 36 | None | -2 | 6 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00073a022 | |||||
3805 | 10466 | 36 | None | -2 | 6 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00073a022 | |||||
3835 | 10466 | 36 | None | -2 | 6 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00073a022 | |||||
CHEMBL235363 | 10466 | 36 | None | -2 | 6 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00073a022 | |||||
44334581 | 12005 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 629 | 3 | 1 | 5 | 6.0 | O=C1C2CN(C(=O)c3sc4ccccc4c3Cl)C3(CCNCC3)C2C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL106273 | 12005 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 629 | 3 | 1 | 5 | 6.0 | O=C1C2CN(C(=O)c3sc4ccccc4c3Cl)C3(CCNCC3)C2C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
2090 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm5017413 | |||||
5311312 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm5017413 | |||||
CHEMBL437797 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm5017413 | |||||
445694 | 126807 | 81 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 164 | 3 | 2 | 2 | 0.0 | NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL350320 | 126807 | 81 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 164 | 3 | 2 | 2 | 0.0 | NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
11305162 | 81545 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL203109 | 81545 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.7 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
44334489 | 114075 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 559 | 3 | 0 | 5 | 4.5 | CN1C(=O)C2CN(Cc3cccs3)C3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2C1=O | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL317209 | 114075 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 559 | 3 | 0 | 5 | 4.5 | CN1C(=O)C2CN(Cc3cccs3)C3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2C1=O | 10.1016/s0960-894x(02)00659-5 | |||
44337354 | 12229 | 0 | None | -58 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 656 | 8 | 2 | 7 | 5.3 | CC(=O)Nc1nc(CN2CCC(NCC(=O)N3CCN(C(=O)c4cc(C)cc(C)c4)C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cs1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL107469 | 12229 | 0 | None | -58 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 656 | 8 | 2 | 7 | 5.3 | CC(=O)Nc1nc(CN2CCC(NCC(=O)N3CCN(C(=O)c4cc(C)cc(C)c4)C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cs1 | 10.1016/s0960-894x(02)00645-5 | |||
44314834 | 211928 | 0 | None | 2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 667 | 11 | 0 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL78092 | 211928 | 0 | None | 2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 667 | 11 | 0 | 5 | 8.7 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(C2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44281771 | 106416 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 630 | 14 | 1 | 8 | 6.7 | CO/N=C(\COCc1cc(OC)c(OC)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL284269 | 106416 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 630 | 14 | 1 | 8 | 6.7 | CO/N=C(\COCc1cc(OC)c(OC)c(OC)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
7088460 | 206059 | 1 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL590275 | 206059 | 1 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
70689371 | 85154 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1372 | 34 | 14 | 16 | -1.0 | CC(C)C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)N1CC[C@@]2(CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)C2CCCN2)C1=O | 10.1016/s0960-894x(98)00219-4 | |||
CHEMBL2110361 | 85154 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 1372 | 34 | 14 | 16 | -1.0 | CC(C)C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)N1CC[C@@]2(CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)C2CCCN2)C1=O | 10.1016/s0960-894x(98)00219-4 | |||
46227360 | 209361 | 0 | None | -151 | 4 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL611924 | 209361 | 0 | None | -151 | 4 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1210 | 18 | 10 | 12 | 4.6 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
18546495 | 147491 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.6 | CN(C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL381744 | 147491 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 437 | 4 | 0 | 1 | 6.6 | CN(C(=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
44380680 | 64361 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 673 | 11 | 1 | 3 | 10.0 | CC/C=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166759 | 64361 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 673 | 11 | 1 | 3 | 10.0 | CC/C=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44318593 | 174773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 552 | 4 | 2 | 3 | 5.0 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(CCc1c[nH]c3ccccc13)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL431974 | 174773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 552 | 4 | 2 | 3 | 5.0 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)NC(=O)N(CCc1c[nH]c3ccccc13)C2=O | 10.1016/s0960-894x(02)00488-2 | |||
44281787 | 169978 | 0 | None | -14 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 597 | 11 | 1 | 6 | 6.2 | CO/N=C(\CN(C)C(=O)c1ccccc1OC)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL418224 | 169978 | 0 | None | -14 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 597 | 11 | 1 | 6 | 6.2 | CO/N=C(\CN(C)C(=O)c1ccccc1OC)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
49863733 | 22104 | 0 | None | 2 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
CHEMBL1214026 | 22104 | 0 | None | 2 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1477 | 21 | 11 | 14 | 6.8 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm100157m | |||
118730932 | 124934 | 0 | None | -2951 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 834 | 15 | 7 | 7 | 3.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408518 | 124934 | 0 | None | -2951 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 834 | 15 | 7 | 7 | 3.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44364003 | 125773 | 0 | None | 9 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 681 | 11 | 0 | 5 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(C(=O)N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL342572 | 125773 | 0 | None | 9 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 681 | 11 | 0 | 5 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(C(=O)N2CCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
10295489 | 147120 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 418 | 5 | 2 | 2 | 4.4 | O=C1NC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL380716 | 147120 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 418 | 5 | 2 | 2 | 4.4 | O=C1NC[C@@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
44281957 | 106592 | 0 | None | 27 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 703 | 10 | 1 | 5 | 8.1 | CO/N=C(\C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL285475 | 106592 | 0 | None | 27 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 703 | 10 | 1 | 5 | 8.1 | CO/N=C(\C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
10010096 | 106666 | 0 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 719 | 10 | 1 | 6 | 8.6 | CO/N=C(\CN(C)C(=O)Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL285986 | 106666 | 0 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 719 | 10 | 1 | 6 | 8.6 | CO/N=C(\CN(C)C(=O)Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
24768356 | 162641 | 0 | None | -4 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
CHEMBL406030 | 162641 | 0 | None | -4 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm070332f | |||
10675169 | 115436 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 605 | 9 | 2 | 4 | 4.9 | CN(C)C(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL320758 | 115436 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 605 | 9 | 2 | 4 | 4.9 | CN(C)C(=O)c1ccccc1NC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N(C)Cc1ccccc1 | 10.1021/jm970499g | |||
44408846 | 147323 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | Cc1ccccc1-c1ccc(N2CCN(C)CC2)nc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL381081 | 147323 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 550 | 5 | 0 | 4 | 6.1 | Cc1ccccc1-c1ccc(N2CCN(C)CC2)nc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
14991605 | 97847 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 325 | 8 | 3 | 3 | 1.2 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397492 | 97847 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 325 | 8 | 3 | 3 | 1.2 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
10229773 | 82276 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 5.5 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1C1CCOCC1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204296 | 82276 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 520 | 6 | 1 | 3 | 5.5 | O=C1NC(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)CN1C1CCOCC1 | 10.1016/j.bmcl.2005.10.072 | |||
44407906 | 81483 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL203064 | 81483 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 715 | 11 | 1 | 6 | 6.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C/C(=N\OCCCN2CCOCC2)c2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2005.10.077 | |||
44408048 | 147336 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 667 | 9 | 1 | 6 | 6.1 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381157 | 147336 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 667 | 9 | 1 | 6 | 6.1 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCC(C)(C)N1CCOCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44407903 | 147500 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 655 | 9 | 1 | 6 | 6.0 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCSCC1 | 10.1016/j.bmcl.2005.10.077 | |||
CHEMBL381778 | 147500 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 655 | 9 | 1 | 6 | 6.0 | C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCSCC1 | 10.1016/j.bmcl.2005.10.077 | |||
44338586 | 13657 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL108422 | 13657 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 462 | 7 | 1 | 4 | 4.9 | COc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
44338584 | 14929 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 6.2 | FC(F)(F)c1cc(COCC(c2ccc(Cl)c(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL109183 | 14929 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 6 | 1 | 3 | 6.2 | FC(F)(F)c1cc(COCC(c2ccc(Cl)c(Cl)c2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
10187704 | 126202 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 556 | 11 | 1 | 6 | 5.1 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(CCCCc3nnn[nH]3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL344847 | 126202 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 556 | 11 | 1 | 6 | 5.1 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(CCCCc3nnn[nH]3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
20599010 | 206146 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 503 | 2 | 1 | 2 | 6.1 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL590833 | 206146 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 503 | 2 | 1 | 2 | 6.1 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
118730933 | 124935 | 0 | None | -389 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3408519 | 124935 | 0 | None | -389 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 698 | 15 | 7 | 7 | 1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)Cc2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
10578261 | 15955 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 535 | 8 | 2 | 4 | 4.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccnc1 | 10.1021/jm970499g | |||
CHEMBL110301 | 15955 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 535 | 8 | 2 | 4 | 4.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1cccnc1 | 10.1021/jm970499g | |||
127033168 | 145552 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1021 | 17 | 7 | 8 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780686 | 145552 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1021 | 17 | 7 | 8 | 5.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CC[C@@H](C(=O)N(C)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccccc3)C2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
56668794 | 72683 | 0 | None | 17 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 806 | 15 | 2 | 5 | 8.9 | O=C(CCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
CHEMBL1835844 | 72683 | 0 | None | 17 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 806 | 15 | 2 | 5 | 8.9 | O=C(CCCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2011.08.027 | |||
44177145 | 202507 | 0 | None | -6 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1191 | 27 | 10 | 10 | 5.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
CHEMBL557188 | 202507 | 0 | None | -6 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1191 | 27 | 10 | 10 | 5.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900473p | |||
9874473 | 48582 | 0 | None | 16 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
CHEMBL149326 | 48582 | 0 | None | 16 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 659 | 10 | 0 | 4 | 8.4 | CCc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm030197g | |||
71549635 | 167653 | 0 | None | -851 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 450 | 4 | 0 | 8 | 4.4 | C[C@@H]1c2nnc(-c3csc(N(C)C)n3)n2CCN1C(=O)c1ccc(-c2cccs2)cc1 | nan | |||
CHEMBL4115030 | 167653 | 0 | None | -851 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 450 | 4 | 0 | 8 | 4.4 | C[C@@H]1c2nnc(-c3csc(N(C)C)n3)n2CCN1C(=O)c1ccc(-c2cccs2)cc1 | nan | |||
145948955 | 174266 | 0 | None | -18 | 4 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
CHEMBL4299466 | 174266 | 0 | None | -18 | 4 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1091 | 22 | 8 | 9 | 5.0 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.5b01170 | |||
44314597 | 111128 | 0 | None | 3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 599 | 10 | 0 | 5 | 7.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL310019 | 111128 | 0 | None | 3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 599 | 10 | 0 | 5 | 7.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
118731113 | 124947 | 0 | None | -43651 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 670 | 14 | 8 | 7 | 1.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408730 | 124947 | 0 | None | -43651 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 670 | 14 | 8 | 7 | 1.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44314298 | 211921 | 0 | None | 4 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 682 | 13 | 1 | 6 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NC2CC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL78065 | 211921 | 0 | None | 4 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 682 | 13 | 1 | 6 | 6.6 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)NC2CC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
10001148 | 58219 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 402 | 6 | 2 | 2 | 5.3 | CNC(c1ccccc1)C1(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 | 10.1016/s0960-894x(01)00020-8 | |||
CHEMBL158212 | 58219 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 402 | 6 | 2 | 2 | 5.3 | CNC(c1ccccc1)C1(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 | 10.1016/s0960-894x(01)00020-8 | |||
CHEMBL5278537 | 200763 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 746 | 11 | 3 | 6 | 6.7 | CC(C)C[C@H](NC(=O)CNC(=O)OCc1ccccc1)C(=O)N1Cc2[nH]c3ccccc3c2C[C@H]1C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/acs.jmedchem.6b01029 | |||
90644622 | 119522 | 0 | None | 25 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.6 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288162 | 119522 | 0 | None | 25 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.6 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305013 | 119522 | 0 | None | 25 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 697 | 12 | 3 | 6 | 5.6 | CN1C(=O)OC2(CCN(CCC[C@@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44358413 | 33680 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 5.8 | CCOC(=O)N1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136389 | 33680 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 5.8 | CCOC(=O)N1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358551 | 36107 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 4.3 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(Cc3nn[nH]n3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL138335 | 36107 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 4.3 | FC(F)(F)c1cc(COCC(c2ccccc2)N2CCN(Cc3nn[nH]n3)CC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
20599010 | 206146 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 503 | 2 | 1 | 2 | 6.1 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
CHEMBL590833 | 206146 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 503 | 2 | 1 | 2 | 6.1 | Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N1CCCC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.11.078 | |||
2089 | 9542 | 28 | None | -102 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
3795 | 9542 | 28 | None | -102 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
5311311 | 9542 | 28 | None | -102 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
CHEMBL217406 | 9542 | 28 | None | -102 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00219-4 | |||||
90644612 | 119497 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 669 | 10 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288157 | 119497 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 669 | 10 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3304538 | 119497 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 669 | 10 | 2 | 6 | 5.5 | CN1C(=O)OC2(CCN(CC[C@@H](C(=O)N(C)[C@H](C(=O)NCCN)c3ccccc3)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
90644618 | 119540 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3288160 | 119540 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
CHEMBL3305331 | 119540 | 0 | None | 3 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 683 | 11 | 3 | 6 | 5.2 | CN1C(=O)OC2(CCN(CC[C@](C)(C(=O)N[C@H](Cc3ccccc3)C(=O)NCCN)c3ccc(Cl)c(Cl)c3)CC2)c2cc(F)ccc21 | 10.1021/ml400528y | |||
44304381 | 108862 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 507 | 3 | 2 | 2 | 6.0 | O=C1CN(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(c2ccccc2)c2ccccc2N1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL302163 | 108862 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 507 | 3 | 2 | 2 | 6.0 | O=C1CN(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(c2ccccc2)c2ccccc2N1 | 10.1016/S0960-894X(97)00353-3 | |||
7037588 | 206060 | 1 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
CHEMBL590276 | 206060 | 1 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1 | 10.1021/jm901352b | |||
44318874 | 212445 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 581 | 3 | 0 | 3 | 6.1 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3c(Cl)cccc3Cl)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL82065 | 212445 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 581 | 3 | 0 | 3 | 6.1 | CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C2(CCN(C(=O)c3c(Cl)cccc3Cl)CC2)C1=O | 10.1016/s0960-894x(02)00488-2 | |||
3198 | 212292 | 76 | None | -37 | 34 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
CHEMBL1201049 | 212292 | 76 | None | -37 | 34 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
CHEMBL808 | 212292 | 76 | None | -37 | 34 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | nan | |||
131954513 | 168857 | 38 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 357 | 2 | 0 | 4 | 4.3 | COc1ccc(-c2c(C)nn3c(C(F)(F)F)cc(C)nc23)c(F)c1F | 10.1021/acsmedchemlett.7b00317 | |||
CHEMBL4160748 | 168857 | 38 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 357 | 2 | 0 | 4 | 4.3 | COc1ccc(-c2c(C)nn3c(C(F)(F)F)cc(C)nc23)c(F)c1F | 10.1021/acsmedchemlett.7b00317 | |||
11683187 | 206711 | 44 | None | -676 | 5 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2009.11.097 | |||
CHEMBL594828 | 206711 | 44 | None | -676 | 5 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2009.11.097 | |||
8867347 | 67377 | 5 | None | -6 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 362 | 4 | 1 | 4 | 3.0 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccccc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
CHEMBL1760200 | 67377 | 5 | None | -6 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 362 | 4 | 1 | 4 | 3.0 | COc1ccccc1N1CCN(C(=O)c2cc(-c3ccccc3)n[nH]2)CC1 | 10.1016/j.bmcl.2011.02.033 | |||
44408821 | 82166 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 465 | 4 | 0 | 1 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL203928 | 82166 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 465 | 4 | 0 | 1 | 7.3 | CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
73352066 | 97846 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.3 | C[C@H](c1ccccc1)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397491 | 97846 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.3 | C[C@H](c1ccccc1)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44363435 | 43962 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 785 | 14 | 0 | 5 | 9.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(Cc3ccccc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL145314 | 43962 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 785 | 14 | 0 | 5 | 9.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(Cc3ccccc3)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44380733 | 65390 | 0 | None | 7 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 720 | 14 | 1 | 6 | 8.7 | COCCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL168437 | 65390 | 0 | None | 7 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 720 | 14 | 1 | 6 | 8.7 | COCCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44363983 | 24938 | 0 | None | 2 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 769 | 15 | 2 | 7 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CC(O)CO)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL126970 | 24938 | 0 | None | 2 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 769 | 15 | 2 | 7 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC(CC(O)CO)C2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44281958 | 116464 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 646 | 10 | 1 | 6 | 6.4 | CO/N=C(\CN(C)C(=O)c1cncc(Br)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL32273 | 116464 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 646 | 10 | 1 | 6 | 6.4 | CO/N=C(\CN(C)C(=O)c1cncc(Br)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44337289 | 114815 | 0 | None | 3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 624 | 9 | 1 | 6 | 5.3 | COc1cc(OC)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL319474 | 114815 | 0 | None | 3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 624 | 9 | 1 | 6 | 5.3 | COc1cc(OC)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ccccc4)CC3)C(c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
46227363 | 206444 | 0 | None | -28 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL592969 | 206444 | 0 | None | -28 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1210 | 16 | 10 | 12 | 4.7 | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CSSC[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)NC(=O)[C@@H]2CCCN2C1=O | 10.1016/j.bmc.2009.08.035 | |||
10651575 | 11926 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 624 | 10 | 2 | 3 | 6.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL105847 | 11926 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 624 | 10 | 2 | 3 | 6.6 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1Cl | 10.1021/jm970499g | |||
25129133 | 195666 | 0 | None | -10 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
CHEMBL507340 | 195666 | 0 | None | -10 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm800389v | |||
25129133 | 195666 | 0 | None | -10 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
CHEMBL507340 | 195666 | 0 | None | -10 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1208 | 27 | 10 | 11 | 4.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmc.2009.08.035 | |||
44380069 | 64391 | 0 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 714 | 14 | 0 | 6 | 8.1 | CSCCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL166842 | 64391 | 0 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 714 | 14 | 0 | 6 | 8.1 | CSCCCO/N=C(\CN(C)C(=O)c1cc(Cl)cc(Cl)c1)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
127031644 | 145612 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1007 | 16 | 7 | 8 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3781336 | 145612 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1007 | 16 | 7 | 8 | 5.3 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(C)[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
44337288 | 14817 | 0 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 632 | 7 | 1 | 4 | 6.6 | O=C(c1cc(Cl)cc(Cl)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL109092 | 14817 | 0 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 632 | 7 | 1 | 4 | 6.6 | O=C(c1cc(Cl)cc(Cl)c1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
52937467 | 69297 | 0 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL1782141 | 69297 | 0 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 820 | 14 | 7 | 7 | 3.4 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL2419538 | 217218 | 0 | None | -117 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NC1(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCC1 | 10.1016/j.bmcl.2013.06.065 | |||||
10140125 | 34053 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 7 | 0 | 4 | 5.1 | N#CCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL136709 | 34053 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 7 | 0 | 4 | 5.1 | N#CCN1CCN(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
20811360 | 37099 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 489 | 8 | 1 | 4 | 4.1 | NC(=O)CN1CCN([C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL139150 | 37099 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 489 | 8 | 1 | 4 | 4.1 | NC(=O)CN1CCN([C@H](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccccc2)CC1 | 10.1016/s0960-894x(02)00956-3 | |||
44358247 | 125785 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 438 | 6 | 1 | 4 | 4.9 | FC(F)(F)c1cc(COCC(c2cccs2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL342602 | 125785 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 438 | 6 | 1 | 4 | 4.9 | FC(F)(F)c1cc(COCC(c2cccs2)N2CCNCC2)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00956-3 | |||
44338640 | 174868 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 482 | 7 | 1 | 4 | 4.4 | COc1c(Br)cc(Br)cc1COCC(c1ccccc1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL432627 | 174868 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 482 | 7 | 1 | 4 | 4.4 | COc1c(Br)cc(Br)cc1COCC(c1ccccc1)N1CCNCC1 | 10.1016/s0960-894x(02)00956-3 | |||
44337324 | 13483 | 0 | None | -2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 688 | 8 | 3 | 5 | 5.3 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4c[nH]c5ccccc45)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL108364 | 13483 | 0 | None | -2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 688 | 8 | 3 | 5 | 5.3 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(C(=O)[C@H](N)Cc4c[nH]c5ccccc45)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
44314548 | 109686 | 0 | None | 3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 663 | 11 | 0 | 7 | 7.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL306052 | 109686 | 0 | None | 3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 663 | 11 | 0 | 7 | 7.3 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44281516 | 106658 | 0 | None | -3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 608 | 11 | 1 | 5 | 8.0 | CO/N=C(\COCc1ccc(F)c2ccccc12)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL285929 | 106658 | 0 | None | -3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 608 | 11 | 1 | 5 | 8.0 | CO/N=C(\COCc1ccc(F)c2ccccc12)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
73352065 | 97838 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.2 | C[C@](N)(Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397483 | 97838 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 325 | 7 | 3 | 3 | 1.2 | C[C@](N)(Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44550460 | 203816 | 0 | None | -5 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 537 | 8 | 0 | 3 | 5.9 | CC(=O)N(C)C1CCN(CCC(C)(C(=O)N(C)Cc2ccccc2Cl)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm900948q | |||
CHEMBL567198 | 203816 | 0 | None | -5 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 537 | 8 | 0 | 3 | 5.9 | CC(=O)N(C)C1CCN(CCC(C)(C(=O)N(C)Cc2ccccc2Cl)c2ccc(Cl)c(Cl)c2)CC1 | 10.1021/jm900948q | |||
25129135 | 179376 | 0 | None | -1584 | 4 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
CHEMBL448998 | 179376 | 0 | None | -1584 | 4 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1073 | 27 | 10 | 11 | 2.9 | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1 | 10.1021/jm800389v | |||
73347011 | 96184 | 0 | None | 1 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 730 | 6 | 7 | 8 | -0.6 | COc1ccc(CC2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1 | 10.1021/jm00029a007 | |||
CHEMBL2370511 | 96184 | 0 | None | 1 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 730 | 6 | 7 | 8 | -0.6 | COc1ccc(CC2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)cc1 | 10.1021/jm00029a007 | |||
44409000 | 175720 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 423 | 5 | 0 | 1 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL438801 | 175720 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 423 | 5 | 0 | 1 | 7.0 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
118731118 | 124952 | 0 | None | -1202 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 822 | 17 | 7 | 7 | 3.5 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)N(C)CC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408735 | 124952 | 0 | None | -1202 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 822 | 17 | 7 | 7 | 3.5 | Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)N(C)CC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.ejmech.2014.12.033 | |||
44318486 | 112198 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.3 | O=C1NC2(CCN(S(=O)(=O)CCc3cccc4ccccc34)CC2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00488-2 | |||
CHEMBL311946 | 112198 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.3 | O=C1NC2(CCN(S(=O)(=O)CCc3cccc4ccccc34)CC2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00488-2 | |||
118731116 | 124950 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 876 | 17 | 7 | 7 | 4.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
CHEMBL3408733 | 124950 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 876 | 17 | 7 | 7 | 4.8 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC(C)C)C1=O | 10.1016/j.ejmech.2014.12.033 | |||
44281743 | 106415 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 690 | 11 | 1 | 5 | 9.1 | CO/N=C(\C(C)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL284244 | 106415 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 690 | 11 | 1 | 5 | 9.1 | CO/N=C(\C(C)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44334630 | 116432 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 684 | 4 | 0 | 7 | 4.8 | Cc1noc(C)c1S(=O)(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL322453 | 116432 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 684 | 4 | 0 | 7 | 4.8 | Cc1noc(C)c1S(=O)(=O)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL5266880 | 200278 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 498 | 4 | 2 | 3 | 5.3 | CC(=O)NC1(C(=O)OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCc2[nH]c3ccccc3c2C1 | 10.1021/acs.jmedchem.6b01029 | |||
10721590 | 14435 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 10 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
CHEMBL108847 | 14435 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 10 | 2 | 5 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1ccccc1[N+](=O)[O-] | 10.1021/jm970499g | |||
10746828 | 13714 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 650 | 9 | 2 | 3 | 6.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm970499g | |||
CHEMBL108448 | 13714 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 650 | 9 | 2 | 3 | 6.4 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm970499g | |||
CHEMBL2372068 | 216955 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | None | None | None | NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N1CCC(Cc2ccccc2)[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1016/s0960-894x(98)00219-4 | |||||
73212515 | 111381 | 0 | None | 125 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 4.7 | CN(CCN1CCOCC1)C(=O)[C@@H](NC(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104778 | 111381 | 0 | None | 125 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 8 | 1 | 4 | 4.7 | CN(CCN1CCOCC1)C(=O)[C@@H](NC(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
44338510 | 15405 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00956-3 | |||
CHEMBL109514 | 15405 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 450 | 6 | 1 | 3 | 5.0 | Fc1ccc(C(COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)N2CCNCC2)cc1 | 10.1016/s0960-894x(02)00956-3 | |||
57394644 | 75140 | 0 | None | - | 1 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 721 | 10 | 4 | 6 | 4.3 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | |||
CHEMBL1916633 | 75140 | 0 | None | - | 1 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 721 | 10 | 4 | 6 | 4.3 | COC(=O)C1=C2CCC(C(=O)N[C@@H](CCc3c[nH]c4ccccc34)C(=O)NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2C(=O)C(NC(C)=O)C1 | 10.1016/j.ejmech.2011.08.042 | |||
44334582 | 168472 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 597 | 3 | 0 | 5 | 4.1 | COc1ccccc1C(=O)N1CC2C(=O)N(C)C(=O)C2C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL413383 | 168472 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 597 | 3 | 0 | 5 | 4.1 | COc1ccccc1C(=O)N1CC2C(=O)N(C)C(=O)C2C12CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC2 | 10.1016/s0960-894x(02)00659-5 | |||
73212519 | 111376 | 0 | None | 12 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 517 | 8 | 2 | 4 | 3.6 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H](C(=O)NCCN1CCOCC1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
CHEMBL3104773 | 111376 | 0 | None | 12 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 517 | 8 | 2 | 4 | 3.6 | O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H](C(=O)NCCN1CCOCC1)c1ccccc1 | 10.1016/j.bmcl.2013.12.033 | |||
44304323 | 107360 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 544 | 4 | 1 | 4 | 4.6 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1CN1CCOCC1 | 10.1016/S0960-894X(97)00353-3 | |||
CHEMBL291650 | 107360 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 544 | 4 | 1 | 4 | 4.6 | CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N1CC(=O)Nc2ccccc2C1CN1CCOCC1 | 10.1016/S0960-894X(97)00353-3 | |||
90417914 | 125643 | 0 | None | -2570 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 433 | 4 | 0 | 7 | 5.0 | CC(C)c1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)co1 | 10.1021/jm5017413 | |||
CHEMBL3422015 | 125643 | 0 | None | -2570 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 433 | 4 | 0 | 7 | 5.0 | CC(C)c1nc(-c2nnc3n2CCN(C(=O)c2ccc(-c4cccs4)cc2)[C@@H]3C)co1 | 10.1021/jm5017413 | |||
9887650 | 23423 | 0 | None | -6309 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 407 | 5 | 1 | 3 | 4.3 | O=C1OC2(CCN(CCc3c[nH]c4ccc(F)cc34)CC2)CN1Cc1ccccc1 | 10.1021/jm00019a006 | |||
CHEMBL124208 | 23423 | 0 | None | -6309 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 407 | 5 | 1 | 3 | 4.3 | O=C1OC2(CCN(CCc3c[nH]c4ccc(F)cc34)CC2)CN1Cc1ccccc1 | 10.1021/jm00019a006 | |||
44380794 | 127061 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 720 | 13 | 2 | 6 | 8.2 | O=C(O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL352614 | 127061 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 720 | 13 | 2 | 6 | 8.2 | O=C(O)CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
10078301 | 126010 | 0 | None | 2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 681 | 12 | 0 | 5 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL343447 | 126010 | 0 | None | 2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 681 | 12 | 0 | 5 | 8.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(CN2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44364002 | 127826 | 0 | None | 8 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 627 | 11 | 1 | 5 | 6.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL356796 | 127826 | 0 | None | 8 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 627 | 11 | 1 | 5 | 6.9 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(C(N)=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
127033173 | 145622 | 0 | None | -2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1062 | 16 | 7 | 9 | 5.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CCN([C@@H]3CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C[C@@H]3c3ccccc3)CC2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3781519 | 145622 | 0 | None | -2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1062 | 16 | 7 | 9 | 5.0 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N2CCN([C@@H]3CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)C[C@@H]3c3ccccc3)CC2)C1=O | 10.1021/acsmedchemlett.5b00359 | |||
9872295 | 19394 | 1 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL1187084 | 19394 | 1 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL489924 | 19394 | 1 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 491 | 3 | 1 | 2 | 5.9 | Cc1cc(F)ccc1[C@@H]1CNCCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
44334499 | 114077 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 652 | 4 | 0 | 6 | 3.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)CN1CCOCC1 | 10.1016/s0960-894x(02)00659-5 | |||
CHEMBL317238 | 114077 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 652 | 4 | 0 | 6 | 3.7 | O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)C1C(=O)N(c3ccccc3)C(=O)C1CN2C(=O)CN1CCOCC1 | 10.1016/s0960-894x(02)00659-5 | |||
127032846 | 145569 | 0 | None | 4 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1081 | 24 | 9 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
CHEMBL3780818 | 145569 | 0 | None | 4 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 1081 | 24 | 9 | 9 | 5.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)CC(=O)N1CC[C@@H](C(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccccc2)C1 | 10.1021/acsmedchemlett.5b00359 | |||
85169 | 13687 | 10 | None | -2 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL108438 | 13687 | 10 | None | -2 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 311 | 7 | 3 | 3 | 0.8 | NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
9846662 | 82687 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1ccncc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL204958 | 82687 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 452 | 4 | 0 | 2 | 6.4 | Cc1ccccc1-c1ccncc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.11.047 | |||
3668 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
5311081 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
CHEMBL333357 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
CHEMBL589982 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm901352b | |||||
3668 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2018.06.009 | |||||
5311081 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2018.06.009 | |||||
CHEMBL333357 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2018.06.009 | |||||
CHEMBL589982 | 8342 | 42 | None | -38 | 10 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2018.06.009 | |||||
10299289 | 199394 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 477 | 4 | 1 | 3 | 4.6 | Cc1cc(F)ccc1N1CCNCC1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
CHEMBL521605 | 199394 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 477 | 4 | 1 | 3 | 4.6 | Cc1cc(F)ccc1N1CCNCC1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1021/jm900023b | |||
10232846 | 120893 | 0 | None | 11 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
CHEMBL332793 | 120893 | 0 | None | 11 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 623 | 7 | 2 | 3 | 6.1 | CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](/C=C/C(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm030786m | |||
10767720 | 85467 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 500 | 8 | 2 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=S)Nc1ccccc1 | 10.1021/jm970499g | |||
CHEMBL2112476 | 85467 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 500 | 8 | 2 | 3 | 4.2 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=S)Nc1ccccc1 | 10.1021/jm970499g | |||
73351579 | 96180 | 0 | None | -2 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 800 | 7 | 9 | 9 | 0.1 | CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1O | 10.1021/jm00029a007 | |||
CHEMBL2370507 | 96180 | 0 | None | -2 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 800 | 7 | 9 | 9 | 0.1 | CC(C)=CCc1cc(C(O)C2NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)CNC2=O)ccc1O | 10.1021/jm00029a007 | |||
10792994 | 14286 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 560 | 7 | 2 | 3 | 4.5 | O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCc2ccccc2C1)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
CHEMBL108725 | 14286 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 560 | 7 | 2 | 3 | 4.5 | O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCc2ccccc2C1)[C@@H]1CCCN1C(=S)NCc1ccccc1Cl | 10.1021/jm970499g | |||
44380763 | 126811 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 690 | 12 | 1 | 5 | 9.1 | CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
CHEMBL350360 | 126811 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 690 | 12 | 1 | 5 | 9.1 | CCO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(02)00027-6 | |||
44281476 | 106707 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 662 | 10 | 1 | 5 | 8.6 | CO/N=C(\COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL286235 | 106707 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 662 | 10 | 1 | 5 | 8.6 | CO/N=C(\COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44314533 | 112456 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 710 | 12 | 0 | 6 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL312539 | 112456 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 710 | 12 | 0 | 6 | 7.4 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44314946 | 211842 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 726 | 14 | 0 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N(C(C)C)C(C)C)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL77235 | 211842 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 726 | 14 | 0 | 6 | 8.0 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N(C(C)C)C(C)C)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
1016 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
2561 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
2733526 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
5384 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
CHEMBL83 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
DB00675 | 10519 | 78 | None | -39 | 35 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | nan | |||
2247 | 7293 | 81 | None | -117 | 42 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
249 | 7293 | 81 | None | -117 | 42 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
2603 | 7293 | 81 | None | -117 | 42 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
CHEMBL296419 | 7293 | 81 | None | -117 | 42 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
DB00637 | 7293 | 81 | None | -117 | 42 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
2812 | 11551 | 101 | None | -43 | 34 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
CHEMBL104 | 11551 | 101 | None | -43 | 34 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
44407932 | 82672 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL204918 | 82672 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 436 | 5 | 2 | 2 | 4.6 | O=C1NC[C@](COCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccc(F)cc2)N1 | 10.1016/j.bmcl.2005.10.072 | |||
9940831 | 21418 | 0 | None | 1 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL1205204 | 21418 | 0 | None | 1 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL65468 | 21418 | 0 | None | 1 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 810 | 13 | 4 | 9 | 5.7 | O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
10032406 | 46728 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 667 | 11 | 0 | 5 | 7.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
CHEMBL147824 | 46728 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 667 | 11 | 0 | 5 | 7.8 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(N2CCCC2=O)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00702-2 | |||
44314868 | 162477 | 0 | None | 3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
CHEMBL405129 | 162477 | 0 | None | 3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 705 | 13 | 3 | 5 | 7.1 | NC(=O)CN[C@@H](COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00463-7 | |||
44314487 | 109690 | 0 | None | 5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 753 | 13 | 1 | 7 | 6.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(NC(C)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
CHEMBL306097 | 109690 | 0 | None | 5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 753 | 13 | 1 | 7 | 6.1 | CO/N=C(\COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCN(CC(=O)N2CCC(NC(C)=O)C2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00464-9 | |||
44281672 | 120301 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 596 | 10 | 1 | 6 | 6.2 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL33215 | 120301 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 596 | 10 | 1 | 6 | 6.2 | CO/N=C(\CN(C)C(=O)c1cc(C)nc(C)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL387816 | 219191 | 0 | None | 23 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm901352b | |||||
44611292 | 97839 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 325 | 7 | 2 | 3 | 1.1 | CN(C(=O)[C@@H](N)Cc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
CHEMBL2397484 | 97839 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 325 | 7 | 2 | 3 | 1.1 | CN(C(=O)[C@@H](N)Cc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm400209h | |||
44305818 | 21567 | 0 | None | 1 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL1206764 | 21567 | 0 | None | 1 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL305119 | 21567 | 0 | None | 1 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 698 | 13 | 3 | 8 | 4.3 | CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cn(CCCCc2nnn[nH]2)c2ccccc12 | 10.1016/S0960-894X(96)00604-X | |||
CHEMBL2419539 | 217219 | 0 | None | -81 | 4 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2013.06.065 | |||||
44337173 | 13461 | 0 | None | -30 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 582 | 7 | 2 | 5 | 4.6 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ncc[nH]4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL108350 | 13461 | 0 | None | -30 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 582 | 7 | 2 | 5 | 4.6 | Cc1cc(C)cc(C(=O)N2CCN(C(=O)CNC3CCN(Cc4ncc[nH]4)CC3)[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 | 10.1016/s0960-894x(02)00645-5 | |||
122187725 | 129845 | 0 | None | -107 | 4 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 691 | 11 | 6 | 5 | 4.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
CHEMBL3609621 | 129845 | 0 | None | -107 | 4 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 691 | 11 | 6 | 5 | 4.9 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2015.06.030 | |||
44281358 | 105039 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 674 | 11 | 1 | 4 | 9.5 | CO/N=C(\CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL274557 | 105039 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 674 | 11 | 1 | 4 | 9.5 | CO/N=C(\CCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
44337266 | 12070 | 0 | None | -27 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 564 | 7 | 1 | 4 | 5.3 | O=C(c1ccccc1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
CHEMBL106608 | 12070 | 0 | None | -27 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 564 | 7 | 1 | 4 | 5.3 | O=C(c1ccccc1)N1CCN(C(=O)CNC2CCN(Cc3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)C1 | 10.1016/s0960-894x(02)00645-5 | |||
44407896 | 145439 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
CHEMBL377712 | 145439 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 5 | 2 | 2 | 5.0 | C[C@H](OC[C@@]1(c2ccccc2)CNC(=O)N1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.072 | |||
44408697 | 82206 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 409 | 4 | 1 | 3 | 6.8 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1c(Cl)cccc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL204165 | 82206 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 409 | 4 | 1 | 3 | 6.8 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1c(Cl)cccc1Cl | 10.1016/j.bmcl.2005.11.047 | |||
73355028 | 97844 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2397489 | 97844 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 337 | 5 | 2 | 3 | 1.4 | NC(=O)[C@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](N)Cc1ccccc1 | 10.1021/jm400209h | |||
CHEMBL2111789 | 215998 | 0 | None | -3 | 2 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](Cc2ccc(OC(C)(C)C)cc2)NC(=O)CNC1=O | 10.1021/jm00029a007 | |||||
44408910 | 148070 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 341 | 4 | 1 | 3 | 5.5 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
CHEMBL383289 | 148070 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 341 | 4 | 1 | 3 | 5.5 | Clc1cncc(Cl)c1N/N=C/c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2005.11.047 | |||
10409484 | 196440 | 1 | None | - | 1 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 413 | 0 | 2 | 6 | 0.9 | C[C@@]12NC(=O)[C@@H](C[C@@]13c1ccccc1N1C(=O)CN[C@@H]13)n1c2nc2ccccc2c1=O | 10.1021/np50106a005 | |||
CHEMBL515179 | 196440 | 1 | None | - | 1 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 413 | 0 | 2 | 6 | 0.9 | C[C@@]12NC(=O)[C@@H](C[C@@]13c1ccccc1N1C(=O)CN[C@@H]13)n1c2nc2ccccc2c1=O | 10.1021/np50106a005 | |||
44281753 | 106593 | 0 | None | -9 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 626 | 11 | 1 | 5 | 7.8 | CO/N=C(\COCc1cc(F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
CHEMBL285476 | 106593 | 0 | None | -9 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 626 | 11 | 1 | 5 | 7.8 | CO/N=C(\COCc1cc(F)cc(C(F)(F)F)c1)C(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00709-0 | |||
43815 | 193699 | 64 | None | - | 25 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
CHEMBL1708 | 193699 | 64 | None | - | 25 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
CHEMBL490 | 193699 | 64 | None | - | 25 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
132837 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 | |||
9461 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 | |||
CHEMBL22870 | 9018 | 55 | None | 18 | 5 | Human | 8.6 | pIC50 | = | 8.6 | Binding | Guide to Pharmacology | 472 | 6 | 2 | 3 | 5.0 | CC(=O)N[C@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1c[nH]c2c1cccc2 | 7509807 | |||
9329 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | Guide to Pharmacology | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10508446 | |||
9894349 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | Guide to Pharmacology | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10508446 | |||
CHEMBL339486 | 10513 | 5 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | Guide to Pharmacology | 573 | 3 | 0 | 4 | 7.1 | C[C@@H]1CCn2c(C(=O)N(C1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(c1ccc(cc1)C)c1c(c2=O)nccc1 | 10508446 | |||
23653789 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | Guide to Pharmacology | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 19354254 | |||
9280 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | Guide to Pharmacology | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 19354254 | |||
CHEMBL447955 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | Guide to Pharmacology | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 19354254 | |||
DB12973 | 10359 | 24 | None | - | 2 | Human | 10.2 | pIC50 | = | 10.2 | Binding | Guide to Pharmacology | 555 | 5 | 0 | 3 | 7.7 | O=C1CCC(=C1)N1C[C@@H]2[C@@H](C1)[C@@H]([C@H](CC2)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)F | 19354254 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 8.6 | pKd | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 2410593 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 8.6 | pKd | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 2410593 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 8.6 | pKd | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 2410593 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 8.6 | pKd | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 2410593 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 8.6 | pKd | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 2410593 | |||||
9278 | 10622 | 0 | None | - | 1 | Human | 7.0 | pKi | < | 7 | Binding | Guide to Pharmacology | 587 | 6 | 0 | 6 | 7.4 | Clc1ccccc1C(=O)c1cccnc1c1nnn(c1c1ccncc1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F | None | |||
9916461 | 10622 | 0 | None | - | 1 | Human | 7.0 | pKi | < | 7 | Binding | Guide to Pharmacology | 587 | 6 | 0 | 6 | 7.4 | Clc1ccccc1C(=O)c1cccnc1c1nnn(c1c1ccncc1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F | None | |||
CHEMBL3544984 | 10622 | 0 | None | - | 1 | Human | 7.0 | pKi | < | 7 | Binding | Guide to Pharmacology | 587 | 6 | 0 | 6 | 7.4 | Clc1ccccc1C(=O)c1cccnc1c1nnn(c1c1ccncc1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F | None | |||
DB12580 | 10622 | 0 | None | - | 1 | Human | 7.0 | pKi | < | 7 | Binding | Guide to Pharmacology | 587 | 6 | 0 | 6 | 7.4 | Clc1ccccc1C(=O)c1cccnc1c1nnn(c1c1ccncc1)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F | None | |||
2098 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 10.4 | pKi | = | 10.4 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 10.3 | pKi | = | 10.3 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 10.3 | pKi | = | 10.3 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 10.3 | pKi | = | 10.3 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 10.3 | pKi | = | 10.3 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 10.3 | pKi | = | 10.3 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | -2 | 6 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | 1 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
2098 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-Bolton Hunter | -1 | 6 | Rat | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
None | 222966 | 0 | 125I-Bolton Hunter | 2 | 5 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 588 | 8 | 2 | 5 | 4.3 | CN1C=C(C2=CC=CC=C21)C(=O)N3CC(CC3C(=O)NC(CC4=CC5=CC=CC=C5C=C4)C(=O)N(C)CC6=CC=CC=C6)O | None | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | None | |||
202 | 8290 | 77 | UNDEFINED | -9 | 33 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
60835 | 8290 | 77 | UNDEFINED | -9 | 33 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
972 | 8290 | 77 | UNDEFINED | -9 | 33 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
CHEMBL1175 | 8290 | 77 | UNDEFINED | -9 | 33 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
DB00476 | 8290 | 77 | UNDEFINED | -9 | 33 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
5656 | 209845 | 87 | UNDEFINED | -7 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
CHEMBL637 | 209845 | 87 | UNDEFINED | -7 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
54841 | 209906 | 52 | UNDEFINED | -1 | 30 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
CHEMBL641 | 209906 | 52 | UNDEFINED | -1 | 30 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
3075702 | 224111 | 0 | 3H-SP | -2 | 37 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 198 | 3 | 1 | 3 | 1.5 | C1CNC1COC2=CN=C(C=C2)Cl | None | |||
119376 | 8622 | 48 | 3H-SUBSTANCE P | -54954 | 27 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
247 | 8622 | 48 | 3H-SUBSTANCE P | -54954 | 27 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
CHEMBL33884 | 8622 | 48 | 3H-SUBSTANCE P | -54954 | 27 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
3294 | 8787 | 111 | 3H-Sar9SP | -14454 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
71360 | 8787 | 111 | 3H-Sar9SP | -14454 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
87 | 8787 | 111 | 3H-Sar9SP | -14454 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
CHEMBL14376 | 8787 | 111 | 3H-Sar9SP | -14454 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
DB04946 | 8787 | 111 | 3H-Sar9SP | -14454 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
243 | 9976 | 91 | 3H-SUBSTANCE P | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
3052762 | 9976 | 91 | 3H-SUBSTANCE P | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
3502 | 9976 | 91 | 3H-SUBSTANCE P | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
CHEMBL117287 | 9976 | 91 | 3H-SUBSTANCE P | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
DB06480 | 9976 | 91 | 3H-SUBSTANCE P | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
21830793 | 98610 | 10 | 3H-8-OH-DPAT | -66069 | 46 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | None | |||
CHEMBL2413154 | 98610 | 10 | 3H-8-OH-DPAT | -66069 | 46 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | None | |||
133090 | 105199 | 20 | 125I-[MePhe7]-NKB | -630 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 5 | 2 | 3 | 5.5 | CCC(NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1 | None | |||
CHEMBL275544 | 105199 | 20 | 125I-[MePhe7]-NKB | -630 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 5 | 2 | 3 | 5.5 | CCC(NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1 | None | |||
44208932 | 147485 | 7 | UNDEFINED | -89125 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | |||
CHEMBL381689 | 147485 | 7 | UNDEFINED | -89125 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | |||
1973 | 210262 | 15 | 125I-[SAR9, Met(O2)11]-SP | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
CHEMBL1394464 | 210262 | 15 | 125I-[SAR9, Met(O2)11]-SP | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
CHEMBL66089 | 210262 | 15 | 125I-[SAR9, Met(O2)11]-SP | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
5079497 | 222853 | 0 | 125I-[MePhe7]-NKB | -1445 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 841 | 26 | 8 | 10 | -0.0 | CC(C)CC(C(=O)NC(CCSC)C(=O)N)NC(=O)CNC(=O)C(CC1=CC=CC=C1)N(C)C(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(=O)O)NC(=O)CCC(=O)O | None | |||
None | 222907 | 0 | 3H-Leu,4,5 Substance P | -1 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 164 | 3 | 1 | 3 | 0.8 | C1CNC1COC2=CN=CC=C2 | None | |||
119380 | 222908 | 0 | 3H-Leu,4,5 Substance P | -1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 166 | 1 | 0 | 3 | 1.8 | CC1=NOC(=C1)C2CCCN2C | None | |||
None | 223272 | 0 | 3H-SUBSTANCE P | -10471285 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 372 | 2 | 1 | 3 | 4.4 | CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)Cl | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222854 | 0 | 3H-SUBSTANCE P | -354 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
2098 | 10466 | 36 | 125I-[MePhe7]-NKB | 1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
36511 | 10466 | 36 | 125I-[MePhe7]-NKB | 1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3805 | 10466 | 36 | 125I-[MePhe7]-NKB | 1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
3835 | 10466 | 36 | 125I-[MePhe7]-NKB | 1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
CHEMBL235363 | 10466 | 36 | 125I-[MePhe7]-NKB | 1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
None | 222854 | 0 | 125I-Bolton Hunter | -1202 | 8 | Rat | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222966 | 0 | 125I-Bolton Hunter | -1412 | 5 | Rat | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 588 | 8 | 2 | 5 | 4.3 | CN1C=C(C2=CC=CC=C21)C(=O)N3CC(CC3C(=O)NC(CC4=CC5=CC=CC=C5C=C4)C(=O)N(C)CC6=CC=CC=C6)O | None | |||
None | 222967 | 0 | 125I-Bolton Hunter | -2 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 1041 | 17 | 10 | 13 | 0.9 | CCCCCC1=CC=CC=C1CCC(=O)NC2C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(=CC3=CC=C(C=C3)O)N(C2=O)C)CC(C)C)CC4=CC=CC=C4)C(C)O)CC(=O)N)CO)C | None | |||
9850582 | 204021 | 22 | 125I-Bolton Hunter | -309 | 6 | Guinea pig | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
CHEMBL56835 | 204021 | 22 | 125I-Bolton Hunter | -309 | 6 | Guinea pig | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222967 | 0 | 125I-Bolton Hunter | -2 | 6 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 1041 | 17 | 10 | 13 | 0.9 | CCCCCC1=CC=CC=C1CCC(=O)NC2C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(=CC3=CC=C(C=C3)O)N(C2=O)C)CC(C)C)CC4=CC=CC=C4)C(C)O)CC(=O)N)CO)C | None | |||
9850582 | 204021 | 22 | 3H-Sar9,Met(O2)11-Substance P | -588 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
CHEMBL56835 | 204021 | 22 | 3H-Sar9,Met(O2)11-Substance P | -588 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
None | 222854 | 0 | 3H-Sar9,Met(O2)11-Substance P | -354 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222966 | 0 | 125I-Bolton Hunter | -2 | 5 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 588 | 8 | 2 | 5 | 4.3 | CN1C=C(C2=CC=CC=C21)C(=O)N3CC(CC3C(=O)NC(CC4=CC5=CC=CC=C5C=C4)C(=O)N(C)CC6=CC=CC=C6)O | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
9850582 | 204021 | 22 | 125I-[MePhe7]-NKB | -588 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
CHEMBL56835 | 204021 | 22 | 125I-[MePhe7]-NKB | -588 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
2812 | 11551 | 101 | None | -43 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
CHEMBL104 | 11551 | 101 | None | -43 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
2247 | 7293 | 81 | None | -117 | 42 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
249 | 7293 | 81 | None | -117 | 42 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
2603 | 7293 | 81 | None | -117 | 42 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
CHEMBL296419 | 7293 | 81 | None | -117 | 42 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
DB00637 | 7293 | 81 | None | -117 | 42 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
1016 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
2561 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
2733526 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
5384 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
CHEMBL83 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
DB00675 | 10519 | 78 | None | -39 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 371 | 8 | 0 | 2 | 6.0 | CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1 | None | |||
3198 | 212292 | 76 | None | -37 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | None | |||
CHEMBL1201049 | 212292 | 76 | None | -37 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | None | |||
CHEMBL808 | 212292 | 76 | None | -37 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 380 | 6 | 0 | 3 | 5.8 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | None | |||
4189 | 213701 | 96 | None | -27 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | None | |||
CHEMBL1559 | 213701 | 96 | None | -27 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | None | |||
CHEMBL91 | 213701 | 96 | None | -27 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 414 | 6 | 0 | 3 | 6.5 | Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 | None | |||
None | 222851 | 0 | 125I-[MePhe7]-NKB | -676 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 1210 | 38 | 14 | 16 | -1.6 | CC(C)CC(C(=O)NC(CCSC)C(=O)N)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(=O)O)NC(=O)C(CC3=CN=CN3)NC(=O)C(CCSC)NC(=O)C(CC(=O)O)N | None | |||
9850582 | 204021 | 22 | 125I-Bolton Hunter | -588 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
CHEMBL56835 | 204021 | 22 | 125I-Bolton Hunter | -588 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(c2ccccc2)CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 | None | |||
None | 222854 | 0 | 125I-Bolton Hunter | -354 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
None | 222852 | 0 | 125I-[MePhe7]-NKB | -851 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 1133 | 37 | 16 | 17 | -4.6 | CC(C)CC(C(=O)NC(CCSC)C(=O)N)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CO)NC(=O)C(CC(=O)O)NC(=O)C(C(C)O)NC(=O)C(CCCCN)NC(=O)C(CC2=CN=CN2)N | None | |||
None | 222854 | 0 | 125I-[MePhe7]-NKB | -354 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 605 | 8 | 0 | 3 | 7.4 | CC(=O)N(C)C1(CCN(CC1)CCCC2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 | None | |||
4898 | 9541 | 86 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | None | |||
5742 | 9541 | 86 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | None | |||
6451149 | 9541 | 86 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | None | |||
CHEMBL206253 | 9541 | 86 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | None | |||
DB09048 | 9541 | 86 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | None | |||
71544786 | 224528 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 689 | 8 | 2 | 5 | 6.4 | CN(C(=O)C(C)(C)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CN=C(C=C1C1=C(C)C=CC=C1)N1CC[N+](C)(COP(O)(O)=O)CC1 | None | |||
10311306 | 10140 | 52 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | None | |||
5027 | 10140 | 52 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | None | |||
5749 | 10140 | 52 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | None | |||
CHEMBL3707331 | 10140 | 52 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | None | |||
DB09291 | 10140 | 52 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | None | |||
23725089 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
4401 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
5758 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
9917021 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
CHEMBL1672054 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
DB06634 | 7591 | 13 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | None | |||
None | 222967 | 0 | 125I-Bolton Hunter | 2 | 6 | Guinea pig | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 1041 | 17 | 10 | 13 | 0.9 | CCCCCC1=CC=CC=C1CCC(=O)NC2C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(=CC3=CC=C(C=C3)O)N(C2=O)C)CC(C)C)CC4=CC=CC=C4)C(C)O)CC(=O)N)CO)C | None | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
135413536 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
230 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
3490 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
6918365 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
CHEMBL1471 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 10737756 | |||
DB00673 | 7236 | 85 | None | 50 | 2 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 534 | 6 | 2 | 5 | 5.0 | Fc1ccc(cc1)[C@H]1[C@H](OCCN1Cc1[nH][nH]c(=O)n1)O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 9804700 | |||
10158788 | 10500 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 415 | 6 | 2 | 4 | 5.0 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)c1ccc(cc1F)C#N | 18187929 | |||
5746 | 10500 | 0 | None | - | 1 | Human | 10.1 | pKi | = | 10.1 | Binding | Guide to Pharmacology | 415 | 6 | 2 | 4 | 5.0 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)c1ccc(cc1F)C#N | 18187929 | |||
5752 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | Guide to Pharmacology | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 8876035 | |||
6918331 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | Guide to Pharmacology | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 8876035 | |||
CHEMBL522302 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | Guide to Pharmacology | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 8876035 | |||
DB12436 | 10777 | 24 | None | - | 1 | Human | 10.6 | pKi | = | 10.6 | Binding | Guide to Pharmacology | 432 | 6 | 2 | 7 | 3.3 | COc1ccc(cc1CN[C@H]1CCCN[C@H]1c1ccccc1)n1nnnc1C(F)(F)F | 8876035 | |||
2087 | 8701 | 0 | None | 31 | 4 | Human | 10.8 | pKi | = | 10.8 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
119137 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
119137 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
2095 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
2095 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
CHEMBL1885865 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
CHEMBL1885865 | 10357 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
5759 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | Guide to Pharmacology | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 16332435 | |||
6450815 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | Guide to Pharmacology | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 16332435 | |||
CHEMBL204694 | 7381 | 24 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | Guide to Pharmacology | 565 | 5 | 0 | 4 | 6.9 | O=C(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)N(c1cnc(cc1c1ccccc1C)N1CCOCC1)C | 16332435 | |||
4898 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 16332435 | |||
5742 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 16332435 | |||
6451149 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 16332435 | |||
CHEMBL206253 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 16332435 | |||
DB09048 | 9541 | 86 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 578 | 5 | 0 | 4 | 6.8 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C | 16332435 | |||
107967 | 8427 | 0 | None | 1000 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 588 | 8 | 2 | 5 | 4.3 | O[C@@H]1C[C@H](N(C1)C(=O)c1cn(c2c1cccc2)C)C(=O)N[C@H](C(=O)N(Cc1ccccc1)C)Cc1ccc2c(c1)cccc2 | 8630576 | |||
2114 | 8427 | 0 | None | 1000 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 588 | 8 | 2 | 5 | 4.3 | O[C@@H]1C[C@H](N(C1)C(=O)c1cn(c2c1cccc2)C)C(=O)N[C@H](C(=O)N(Cc1ccccc1)C)Cc1ccc2c(c1)cccc2 | 8630576 | |||
CHEMBL1416993 | 8427 | 0 | None | 1000 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 588 | 8 | 2 | 5 | 4.3 | O[C@@H]1C[C@H](N(C1)C(=O)c1cn(c2c1cccc2)C)C(=O)N[C@H](C(=O)N(Cc1ccccc1)C)Cc1ccc2c(c1)cccc2 | 8630576 | |||
10311306 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | 22497992 | |||
5027 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | 22497992 | |||
5749 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | 22497992 | |||
CHEMBL3707331 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | 22497992 | |||
DB09291 | 10140 | 52 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 500 | 5 | 2 | 3 | 5.7 | O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1 | 22497992 | |||
10462 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 16332435 | |||
9808518 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 16332435 | |||
CHEMBL206488 | 8797 | 10 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 550 | 5 | 0 | 4 | 6.1 | CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)C(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C | 16332435 | |||
5754 | 10040 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 660 | 7 | 1 | 4 | 6.8 | O=C(Nc1c(C)cccc1C)CN1CCN(CC1)[C@H]1CCN([C@@H](C1)Cc1ccccc1)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F | 12130734 | |||
9917716 | 10040 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 660 | 7 | 1 | 4 | 6.8 | O=C(Nc1c(C)cccc1C)CN1CCN(CC1)[C@H]1CCN([C@@H](C1)Cc1ccccc1)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F | 12130734 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 18657401 | |||
5757 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 19388677 | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 18657401 | |||
9832383 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 19388677 | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 18657401 | |||
CHEMBL522987 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 19388677 | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 18657401 | |||
DB11949 | 10758 | 12 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 491 | 3 | 1 | 2 | 5.9 | Fc1ccc(c(c1)C)[C@H]1CNCCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C | 19388677 | |||
23725089 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
23725089 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
4401 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
4401 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
5758 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
5758 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
9917021 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
9917021 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
CHEMBL1672054 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
CHEMBL1672054 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
DB06634 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 20533894 | |||
DB06634 | 7591 | 13 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | 616 | 4 | 0 | 3 | 6.7 | Fc1ccc(c(c1)C)[C@H]1C[C@H](CCN1C(=O)N([C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN(CC1)C(=O)C | 24106886 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 12206858 | |||
2102 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 9190866 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 12206858 | |||
5311057 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 9190866 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 12206858 | |||
CHEMBL441225 | 7972 | 21 | None | -2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | 296 | 5 | 2 | 3 | 3.3 | COc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1 | 9190866 | |||
188927 | 8396 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | 454 | 8 | 1 | 3 | 6.2 | COc1ccc(cc1CN[C@H]1C2CCN([C@H]1C(c1ccccc1)c1ccccc1)CC2)C(C)C | 12372904 | |||
5751 | 8396 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | 454 | 8 | 1 | 3 | 6.2 | COc1ccc(cc1CN[C@H]1C2CCN([C@H]1C(c1ccccc1)c1ccccc1)CC2)C(C)C | 12372904 | |||
CHEMBL515966 | 8396 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | 454 | 8 | 1 | 3 | 6.2 | COc1ccc(cc1CN[C@H]1C2CCN([C@H]1C(c1ccccc1)c1ccccc1)CC2)C(C)C | 12372904 | |||
3086681 | 9052 | 17 | None | 89125 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 7473161 | |||
3510 | 9052 | 17 | None | 89125 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 7473161 | |||
CHEMBL42407 | 9052 | 17 | None | 89125 | 3 | Human | 9.9 | pKi | = | 9.9 | Binding | Guide to Pharmacology | 559 | 11 | 2 | 5 | 4.2 | COc1ccccc1CN(C(=O)C)C[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC(CC1)N1CCCCC1 | 7473161 | |||
2090 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
5311312 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
CHEMBL437797 | 9543 | 25 | None | -309 | 4 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
2110 | 9743 | 38 | None | -1258 | 6 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 12206858 | |||
219077 | 9743 | 38 | None | -1258 | 6 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 12206858 | |||
3480 | 9743 | 38 | None | -1258 | 6 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 12206858 | |||
CHEMBL346178 | 9743 | 38 | None | -1258 | 6 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 12206858 | |||
DB04872 | 9743 | 38 | None | -1258 | 6 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 605 | 8 | 0 | 3 | 7.4 | O=C(N1CCC[C@](C1)(CCCN1CCC(CC1)(c1ccccc1)N(C(=O)C)C)c1ccc(c(c1)Cl)Cl)c1ccccc1 | 12206858 | |||
104974 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 12206858 | |||
104974 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 9190866 | |||
2111 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 12206858 | |||
2111 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 9190866 | |||
3481 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 12206858 | |||
3481 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 9190866 | |||
CHEMBL308148 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 12206858 | |||
CHEMBL308148 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 9190866 | |||
DB06660 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 12206858 | |||
DB06660 | 10248 | 31 | None | -1202 | 7 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 551 | 9 | 1 | 3 | 6.4 | CC(=O)NC1(CCN(CC1)CC[C@@H](c1ccc(c(c1)Cl)Cl)CN(C(=O)c1ccccc1)C)c1ccccc1 | 9190866 | |||
2105 | 10050 | 0 | None | - | 1 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | None | None | None | None | 12206858 | |||||
2089 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
2089 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 1311270 | |||||
2089 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
2089 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
3795 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
3795 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 1311270 | |||||
3795 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
3795 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
5311311 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
5311311 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 1311270 | |||||
5311311 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
5311311 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
CHEMBL217406 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
CHEMBL217406 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 1311270 | |||||
CHEMBL217406 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 8985159 | |||||
CHEMBL217406 | 9542 | 28 | None | -102 | 5 | Human | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9190866 | |||||
2106 | 10319 | 4 | None | -5 | 3 | Human | 8.6 | pKi | None | 8.6 | Binding | Guide to Pharmacology | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 12206858 | |||
9875034 | 10319 | 4 | None | -5 | 3 | Human | 8.6 | pKi | None | 8.6 | Binding | Guide to Pharmacology | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 12206858 | |||
CHEMBL77023 | 10319 | 4 | None | -5 | 3 | Human | 8.6 | pKi | None | 8.6 | Binding | Guide to Pharmacology | 711 | 12 | 1 | 6 | 6.4 | CO/N=C(/[C@@H](c1ccc(c(c1)Cl)Cl)CCN1CCC(CC1)N1CCC[C@@H](C1=O)CC(=O)NC)\CN(C(=O)c1cc(Cl)cc(c1)Cl)C | 12206858 | |||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
2098 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 15265501 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
36511 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 15265501 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
3805 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 15265501 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
3835 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 15265501 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11786503 | |||||
CHEMBL235363 | 10466 | 36 | None | 1 | 6 | Human | 9.4 | pKi | None | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 15265501 |