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 |
CHEMBL5077128 | 221262 | 7 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | None | None | None | CS(=O)(=O)C1(CNCc2cccc3cccnc23)CC1 | 10.1021/acs.jmedchem.1c02031 | ||||
CHEMBL5082447 | 221582 | 2 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | None | None | None | CS(=O)(=O)C1(CNCc2ccc(Cl)c3cccnc23)CC1 | 10.1021/acs.jmedchem.1c02031 | ||||
785909 | 47822 | 7 | None | 1 | 2 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 336 | 4 | 1 | 3 | 4.1 | COc1ccc(CN2CCc3c([nH]c4ccccc34)C2)c(OC)c1C | nan | ||
CHEMBL1487650 | 47822 | 7 | None | 1 | 2 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 336 | 4 | 1 | 3 | 4.1 | COc1ccc(CN2CCc3c([nH]c4ccccc34)C2)c(OC)c1C | nan | ||
1765347 | 62893 | 13 | None | -1 | 2 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 324 | 7 | 2 | 3 | 3.8 | COc1ccc(CNCCc2c[nH]c3ccccc23)c(OC)c1C | nan | ||
CHEMBL1606743 | 62893 | 13 | None | -1 | 2 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 324 | 7 | 2 | 3 | 3.8 | COc1ccc(CNCCc2c[nH]c3ccccc23)c(OC)c1C | nan | ||
CHEMBL1625496 | 62893 | 13 | None | -1 | 2 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 324 | 7 | 2 | 3 | 3.8 | COc1ccc(CNCCc2c[nH]c3ccccc23)c(OC)c1C | nan | ||
253793 | 17328 | 45 | None | -1 | 2 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 594 | 2 | 2 | 8 | 6.6 | COc1cc2c3cc1Oc1cc(ccc1O)C[C@@H]1c4c(cc(OC)c(O)c4Oc4ccc(cc4)C[C@H]3N(C)CC2)CCN1C | nan | ||
CHEMBL1169627 | 17328 | 45 | None | -1 | 2 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 594 | 2 | 2 | 8 | 6.6 | COc1cc2c3cc1Oc1cc(ccc1O)C[C@@H]1c4c(cc(OC)c(O)c4Oc4ccc(cc4)C[C@H]3N(C)CC2)CCN1C | nan | ||
1795 | 8372 | 64 | None | -10 | 4 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 299 | 4 | 3 | 5 | 0.4 | CCN(c1nc(N)c(nc1Cl)C(=O)N=C(N)N)C(C)C | nan | ||
4186 | 8372 | 64 | None | -10 | 4 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 299 | 4 | 3 | 5 | 0.4 | CCN(c1nc(N)c(nc1Cl)C(=O)N=C(N)N)C(C)C | nan | ||
CHEMBL517986 | 8372 | 64 | None | -10 | 4 | Human | 4.1 | pEC50 | = | 4.1 | Functional | ChEMBL | 299 | 4 | 3 | 5 | 0.4 | CCN(c1nc(N)c(nc1Cl)C(=O)N=C(N)N)C(C)C | nan | ||
16006492 | 104245 | 7 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | ||
CHEMBL270177 | 104245 | 7 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | ||
16006492 | 104245 | 7 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | ||
CHEMBL270177 | 104245 | 7 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | ||
135458393 | 162375 | 4 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | ||
CHEMBL404511 | 162375 | 4 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | ||
135458392 | 104201 | 5 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | ||
CHEMBL269964 | 104201 | 5 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 |
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 |
5329102 | 201505 | 86 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 398 | 7 | 3 | 3 | 3.3 | CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C | 10.1038/s41467-023-40064-9 | |||
CHEMBL535 | 201505 | 86 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 398 | 7 | 3 | 3 | 3.3 | CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C | 10.1038/s41467-023-40064-9 | |||
1353 | 8692 | 93 | None | -77 | 85 | Human | 5.0 | pAC50 | = | 5.0 | 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 | -77 | 85 | Human | 5.0 | pAC50 | = | 5.0 | 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 | -77 | 85 | Human | 5.0 | pAC50 | = | 5.0 | 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 | -77 | 85 | Human | 5.0 | pAC50 | = | 5.0 | 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 | -77 | 85 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
1613 | 9127 | 53 | None | -19 | 44 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
205 | 9127 | 53 | None | -19 | 44 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
3964 | 9127 | 53 | None | -19 | 44 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL831 | 9127 | 53 | None | -19 | 44 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
DB00408 | 9127 | 53 | None | -19 | 44 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
3158 | 63041 | 27 | None | - | 20 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
CHEMBL1628227 | 63041 | 27 | None | - | 20 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
2247 | 7293 | 81 | None | - | 42 | Human | 5.8 | pAC50 | = | 5.8 | 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 | - | 42 | Human | 5.8 | pAC50 | = | 5.8 | 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 | - | 42 | Human | 5.8 | pAC50 | = | 5.8 | 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 | - | 42 | Human | 5.8 | pAC50 | = | 5.8 | 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 | - | 42 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
135409453 | 10545 | 41 | None | - | 2 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
226 | 10545 | 41 | None | - | 2 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
CHEMBL76370 | 10545 | 41 | None | - | 2 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
1427 | 8794 | 54 | None | - | 27 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
357 | 8794 | 54 | None | - | 27 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
3696 | 8794 | 54 | None | - | 27 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL11 | 8794 | 54 | None | - | 27 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
DB00458 | 8794 | 54 | None | - | 27 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
135398745 | 9688 | 112 | None | -109 | 65 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
47 | 9688 | 112 | None | -109 | 65 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL715 | 9688 | 112 | None | -109 | 65 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
DB00334 | 9688 | 112 | None | -109 | 65 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
1400 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
3658 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
7199 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
91513 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
CHEMBL896 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
DB00557 | 8738 | 70 | None | - | 3 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
2726 | 7706 | 68 | None | -16 | 72 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
621 | 7706 | 68 | None | -16 | 72 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
83 | 7706 | 68 | None | -16 | 72 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL71 | 7706 | 68 | None | -16 | 72 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
DB00477 | 7706 | 68 | None | -16 | 72 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
43815 | 193699 | 64 | None | - | 25 | Human | 5.3 | pAC50 | = | 5.3 | 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 | 5.3 | pAC50 | = | 5.3 | 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 | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
21722 | 24764 | 31 | None | - | 6 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
CHEMBL126224 | 24764 | 31 | None | - | 6 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
191 | 7191 | 98 | None | - | 29 | Human | 6.2 | pAC50 | = | 6.2 | 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 | 6.2 | pAC50 | = | 6.2 | 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 | 6.2 | pAC50 | = | 6.2 | 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 | 6.2 | pAC50 | = | 6.2 | 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 | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
1224 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
3100 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
8980 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
916 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL657 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
DB01075 | 8214 | 83 | None | - | 13 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
2284 | 9956 | 33 | None | - | 29 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
4926 | 9956 | 33 | None | - | 29 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
7281 | 9956 | 33 | None | - | 29 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
CHEMBL564 | 9956 | 33 | None | - | 29 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
DB00420 | 9956 | 33 | None | - | 29 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
44469677 | 21945 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 336 | 4 | 1 | 4 | 5.4 | C/C(=N\OC(=O)Nc1ccccc1)c1cccc(-c2cccs2)c1 | 10.1016/j.bmcl.2010.06.050 | |||
CHEMBL1210154 | 21945 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 336 | 4 | 1 | 4 | 5.4 | C/C(=N\OC(=O)Nc1ccccc1)c1cccc(-c2cccs2)c1 | 10.1016/j.bmcl.2010.06.050 | |||
10383252 | 11359 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 350 | 5 | 2 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3C(C)(C)CNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL102645 | 11359 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 350 | 5 | 2 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3C(C)(C)CNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
72548703 | 168346 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
CHEMBL4128926 | 168346 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
10404770 | 11488 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 336 | 6 | 2 | 3 | 1.0 | CN(C)CCc1c[nH]c2ccc(CCN3CCNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL103549 | 11488 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 336 | 6 | 2 | 3 | 1.0 | CN(C)CCc1c[nH]c2ccc(CCN3CCNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
10021702 | 116169 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 1.7 | CCN1CCN(CCc2ccc3[nH]cc(CCN(C)C)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
CHEMBL321963 | 116169 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 1.7 | CCN1CCN(CCc2ccc3[nH]cc(CCN(C)C)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
10043491 | 116601 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 350 | 5 | 1 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3CCCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL323334 | 116601 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 350 | 5 | 1 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3CCCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.03.006 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.03.006 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.03.006 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.03.006 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.11.014 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.11.014 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.11.014 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2016.11.014 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm701575k | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm701575k | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm701575k | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm701575k | |||
10315894 | 11459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(CCN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL103371 | 11459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 350 | 6 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(CCN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
10412397 | 11460 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 469 | 8 | 2 | 4 | 2.8 | CC(=O)Nc1ccc(CN2CCN(Cc3ccc4[nH]cc(CCN(C)C)c4c3)S2(=O)=O)cc1 | 10.1021/jm00045a006 | |||
CHEMBL103388 | 11460 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 469 | 8 | 2 | 4 | 2.8 | CC(=O)Nc1ccc(CN2CCN(Cc3ccc4[nH]cc(CCN(C)C)c4c3)S2(=O)=O)cc1 | 10.1021/jm00045a006 | |||
10404070 | 85223 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 325 | 4 | 1 | 4 | 1.4 | CN1CCN(Cc2ccc3scc(CCN)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
CHEMBL2111620 | 85223 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 325 | 4 | 1 | 4 | 1.4 | CN1CCN(Cc2ccc3scc(CCN)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
10337965 | 115368 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 350 | 5 | 2 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3CC(C)(C)NS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL320412 | 115368 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 350 | 5 | 2 | 3 | 1.7 | CN(C)CCc1c[nH]c2ccc(CN3CC(C)(C)NS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2013.03.016 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2013.03.016 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2013.03.016 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.bmc.2013.03.016 | |||
10885636 | 117793 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 503 | 9 | 0 | 4 | 5.7 | N#Cc1ccc(CCOC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
CHEMBL326263 | 117793 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 503 | 9 | 0 | 4 | 5.7 | N#Cc1ccc(CCOC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
2543 | 10479 | 68 | None | -1412 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 10.1021/jm00045a006 | |||
5358 | 10479 | 68 | None | -1412 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 10.1021/jm00045a006 | |||
54 | 10479 | 68 | None | -1412 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 10.1021/jm00045a006 | |||
CHEMBL128 | 10479 | 68 | None | -1412 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 10.1021/jm00045a006 | |||
DB00669 | 10479 | 68 | None | -1412 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 10.1021/jm00045a006 | |||
9998879 | 114277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 2.0 | CC(C)N1CCN(Cc2ccc3[nH]cc(CCN(C)C)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
CHEMBL318571 | 114277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 364 | 6 | 1 | 3 | 2.0 | CC(C)N1CCN(Cc2ccc3[nH]cc(CCN(C)C)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
11730467 | 17800 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 10 | 0 | 2 | 6.0 | O=C(CCCc1ccccc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
CHEMBL117537 | 17800 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 10 | 0 | 2 | 6.0 | O=C(CCCc1ccccc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
11722814 | 11534 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 308 | 4 | 2 | 3 | 0.7 | CN1CCN(Cc2ccc3[nH]cc(CCN)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
CHEMBL103854 | 11534 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 308 | 4 | 2 | 3 | 0.7 | CN1CCN(Cc2ccc3[nH]cc(CCN)c3c2)S1(=O)=O | 10.1021/jm00045a006 | |||
10245588 | 114604 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 4 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(N3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL319223 | 114604 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 4 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(N3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm058018d | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm058018d | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm058018d | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm058018d | |||
10340828 | 11136 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 6 | 1 | 3 | 2.8 | CN(C)CCc1c[nH]c2ccc(N3CCN(Cc4ccccc4)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL101138 | 11136 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 6 | 1 | 3 | 2.8 | CN(C)CCc1c[nH]c2ccc(N3CCN(Cc4ccccc4)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
10471382 | 11344 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 0.9 | CN(C)CCc1c[nH]c2ccc(CN3CCNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL102548 | 11344 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 0.9 | CN(C)CCc1c[nH]c2ccc(CN3CCNS3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
10471383 | 11350 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 0.9 | CNCCc1c[nH]c2ccc(CN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL102586 | 11350 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 322 | 5 | 2 | 3 | 0.9 | CNCCc1c[nH]c2ccc(CN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
9819150 | 11440 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 336 | 5 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(CN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
CHEMBL103205 | 11440 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 336 | 5 | 1 | 3 | 1.3 | CN(C)CCc1c[nH]c2ccc(CN3CCN(C)S3(=O)=O)cc12 | 10.1021/jm00045a006 | |||
60152964 | 133568 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 366 | 1 | 2 | 1 | 2.7 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cc(F)cc3F)c2C1 | nan | |||
CHEMBL3654198 | 133568 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 366 | 1 | 2 | 1 | 2.7 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cc(F)cc3F)c2C1 | nan | |||
60151043 | 133576 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 374 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1Cc2c(-c3c(F)cccc3F)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654206 | 133576 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 374 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1Cc2c(-c3c(F)cccc3F)ccc(F)c2C2(CC2)C1 | nan | |||
3233 | 10285 | 44 | None | -10 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/acs.jmedchem.1c01093 | |||
3247 | 10285 | 44 | None | -10 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/acs.jmedchem.1c01093 | |||
6604889 | 10285 | 44 | None | -10 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/acs.jmedchem.1c01093 | |||
CHEMBL282199 | 10285 | 44 | None | -10 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/acs.jmedchem.1c01093 | |||
DB13988 | 10285 | 44 | None | -10 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/acs.jmedchem.1c01093 | |||
60151044 | 133582 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 374 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654212 | 133582 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 374 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
60151042 | 133578 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 392 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1Cc2c(-c3c(F)cc(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654208 | 133578 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 392 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1Cc2c(-c3c(F)cc(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
91819725 | 133584 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 356 | 1 | 2 | 1 | 2.9 | NC(N)=NC(=O)N1Cc2c(-c3ccccc3F)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654214 | 133584 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 356 | 1 | 2 | 1 | 2.9 | NC(N)=NC(=O)N1Cc2c(-c3ccccc3F)ccc(F)c2C2(CC2)C1 | nan | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
60150902 | 133567 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 382 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cc(F)cc3F)c2C1 | nan | |||
CHEMBL3654197 | 133567 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 382 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cc(F)cc3F)c2C1 | nan | |||
60152965 | 133569 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 348 | 1 | 2 | 1 | 2.5 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cccc3F)c2C1 | nan | |||
CHEMBL3654199 | 133569 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 348 | 1 | 2 | 1 | 2.5 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cccc3F)c2C1 | nan | |||
50923586 | 131938 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
CHEMBL3644535 | 131938 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
60150904 | 133580 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 392 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1Cc2c(-c3cc(F)c(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654210 | 133580 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 392 | 1 | 2 | 1 | 3.2 | NC(N)=NC(=O)N1Cc2c(-c3cc(F)c(F)cc3F)ccc(F)c2C2(CC2)C1 | nan | |||
67961424 | 131928 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2ncc(Cl)c(-c3ccc(F)cc3F)c2c1 | nan | |||
CHEMBL3644525 | 131928 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2ncc(Cl)c(-c3ccc(F)cc3F)c2c1 | nan | |||
50923580 | 131933 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 358 | 2 | 2 | 2 | 3.0 | Cc1cnc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
CHEMBL3644530 | 131933 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 358 | 2 | 2 | 2 | 3.0 | Cc1cnc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
44456033 | 162346 | 3 | None | 1 | 8 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404372 | 162346 | 3 | None | 1 | 8 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
50923443 | 131931 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 344 | 2 | 2 | 2 | 2.7 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
CHEMBL3644528 | 131931 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 344 | 2 | 2 | 2 | 2.7 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
CHEMBL5093295 | 222200 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | Clc1ccc(CNC[C@H]2CCn3ccnc3C2)c2ncccc12 | 10.1021/acs.jmedchem.1c02031 | |||||
91819723 | 133577 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 362 | 1 | 2 | 1 | 3.1 | CC1CN(C(=O)N=C(N)N)Cc2c(-c3c(F)cccc3F)ccc(F)c21 | nan | |||
CHEMBL3654207 | 133577 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 362 | 1 | 2 | 1 | 3.1 | CC1CN(C(=O)N=C(N)N)Cc2c(-c3c(F)cccc3F)ccc(F)c21 | nan | |||
50923442 | 131930 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3Cl)c2c1 | nan | |||
CHEMBL3644527 | 131930 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3Cl)c2c1 | nan | |||
44456033 | 162346 | 3 | None | -1 | 8 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404372 | 162346 | 3 | None | -1 | 8 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
50923723 | 131943 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 322 | 2 | 2 | 2 | 2.8 | Cc1cnc(-c2ccccc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
CHEMBL3644540 | 131943 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 322 | 2 | 2 | 2 | 2.8 | Cc1cnc(-c2ccccc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
136152971 | 102132 | 0 | None | 1 | 6 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL256694 | 102132 | 0 | None | 1 | 6 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
60150901 | 133575 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 381 | 1 | 2 | 2 | 2.9 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3Cl)c2C1 | nan | |||
CHEMBL3654205 | 133575 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 381 | 1 | 2 | 2 | 2.9 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3Cl)c2C1 | nan | |||
50923720 | 131940 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 340 | 2 | 2 | 2 | 2.9 | Cc1cnc(-c2c(F)cccc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
CHEMBL3644537 | 131940 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 340 | 2 | 2 | 2 | 2.9 | Cc1cnc(-c2c(F)cccc2F)c2cc(C(=O)N=C(N)N)ccc12 | nan | |||
16006607 | 102447 | 4 | None | -10 | 5 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 219 | 2 | 2 | 4 | 2.1 | CC(C)Oc1cccc2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL258075 | 102447 | 4 | None | -10 | 5 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 219 | 2 | 2 | 4 | 2.1 | CC(C)Oc1cccc2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
135458393 | 162375 | 4 | None | 2 | 5 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404511 | 162375 | 4 | None | 2 | 5 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
135458392 | 104201 | 5 | None | 1 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL269964 | 104201 | 5 | None | 1 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
135458392 | 104201 | 5 | None | 1 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL269964 | 104201 | 5 | None | 1 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 209 | 0 | 2 | 3 | 2.2 | CNC1=Nc2cccc(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/jm030030n | |||
CHEMBL5285512 | 201078 | 0 | None | -1 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 327 | 2 | 1 | 3 | 4.9 | COc1ccc2[nH]c3c(-c4cn(C)c5ccccc45)nccc3c2c1 | 10.1021/acs.jmedchem.0c01887 | |||
44351139 | 25616 | 0 | None | -1 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.5 | CCn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL128099 | 25616 | 0 | None | -1 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.5 | CCn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
44351140 | 25813 | 0 | None | -3 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL128848 | 25813 | 0 | None | -3 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
1220 | 6975 | 55 | None | -1548 | 44 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
31 | 6975 | 55 | None | -1548 | 44 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
7 | 6975 | 55 | None | -1548 | 44 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
CHEMBL56 | 6975 | 55 | None | -1548 | 44 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
22857296 | 35923 | 0 | None | -123 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 389 | 4 | 2 | 3 | 4.1 | CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 | 10.1021/jm030030n | |||
CHEMBL13816 | 35923 | 0 | None | -123 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 389 | 4 | 2 | 3 | 4.1 | CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 | 10.1021/jm030030n | |||
CHEMBL5083607 | 221652 | 0 | None | -83 | 9 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | None | None | None | COc1ccccc1-c1cc(C2CCN(C)C2)ccc1Cl | 10.1021/acs.jmedchem.1c00110 | |||||
242 | 7258 | 124 | None | -144 | 51 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
34 | 7258 | 124 | None | -144 | 51 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
60795 | 7258 | 124 | None | -144 | 51 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
CHEMBL1112 | 7258 | 124 | None | -144 | 51 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
DB01238 | 7258 | 124 | None | -144 | 51 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
2389 | 10104 | 118 | None | -346 | 66 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
5073 | 10104 | 118 | None | -346 | 66 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
96 | 10104 | 118 | None | -346 | 66 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
CHEMBL85 | 10104 | 118 | None | -346 | 66 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
DB00734 | 10104 | 118 | None | -346 | 66 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
135398737 | 7745 | 93 | None | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030030n | |||
38 | 7745 | 93 | None | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030030n | |||
722 | 7745 | 93 | None | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030030n | |||
CHEMBL42 | 7745 | 93 | None | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030030n | |||
DB00363 | 7745 | 93 | None | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030030n | |||
44397431 | 18529 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 567 | 11 | 1 | 5 | 7.0 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCc3ccc4c(c3)OCO4)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181632 | 18529 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 567 | 11 | 1 | 5 | 7.0 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCc3ccc4c(c3)OCO4)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL186261 | 18529 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 567 | 11 | 1 | 5 | 7.0 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCc3ccc4c(c3)OCO4)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
33630 | 185736 | 99 | None | -13 | 28 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
CHEMBL47050 | 185736 | 99 | None | -13 | 28 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
135514796 | 99833 | 0 | None | 2 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 226 | 1 | 4 | 2 | 1.2 | N=C1NC(=O)/C(=C\c2c[nH]c3ccccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442270 | 99833 | 0 | None | 2 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 226 | 1 | 4 | 2 | 1.2 | N=C1NC(=O)/C(=C\c2c[nH]c3ccccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
136152962 | 104696 | 1 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 175 | 0 | 2 | 3 | 1.6 | CNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL272517 | 104696 | 1 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 175 | 0 | 2 | 3 | 1.6 | CNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
49756 | 211091 | 13 | None | -138 | 8 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 232 | 4 | 1 | 2 | 2.6 | COc1ccc2[nH]c(C)c(CCN(C)C)c2c1 | 10.1021/jm990550b | |||
CHEMBL7143 | 211091 | 13 | None | -138 | 8 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 232 | 4 | 1 | 2 | 2.6 | COc1ccc2[nH]c(C)c(CCN(C)C)c2c1 | 10.1021/jm990550b | |||
CHEMBL4520788 | 220754 | 10 | None | -48 | 25 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CNCc1ccccc1-c1csc([C@H](C)Nc2nc(C)nc3cc(OC)c(OC)cc23)c1 | 10.6019/CHEMBL5212743 | |||||
CHEMBL5078567 | 221344 | 1 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | None | None | None | CN(C)S(=O)(=O)C1(CNCc2ccc(Cl)c3cccnc23)CC1 | 10.1021/acs.jmedchem.1c02031 | |||||
11088692 | 24846 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 326 | 7 | 0 | 3 | 4.2 | CN(CCCOc1ccc(F)cc1)Cc1cn(C)c2ccccc12 | 10.1021/jm030080s | |||
CHEMBL126666 | 24846 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 326 | 7 | 0 | 3 | 4.2 | CN(CCCOc1ccc(F)cc1)Cc1cn(C)c2ccccc12 | 10.1021/jm030080s | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm8007618 | |||
44351116 | 24722 | 1 | None | 1 | 2 | Mouse | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 244 | 3 | 1 | 3 | 1.9 | Cn1c2c(c3ccccc31)CN(CCCO)CC2 | 10.1021/jm030080s | |||
CHEMBL126021 | 24722 | 1 | None | 1 | 2 | Mouse | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 244 | 3 | 1 | 3 | 1.9 | Cn1c2c(c3ccccc31)CN(CCCO)CC2 | 10.1021/jm030080s | |||
136118729 | 99837 | 0 | None | 4 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442274 | 99837 | 0 | None | 4 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
44351116 | 24722 | 1 | None | -1 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 244 | 3 | 1 | 3 | 1.9 | Cn1c2c(c3ccccc31)CN(CCCO)CC2 | 10.1021/jm030080s | |||
CHEMBL126021 | 24722 | 1 | None | -1 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 244 | 3 | 1 | 3 | 1.9 | Cn1c2c(c3ccccc31)CN(CCCO)CC2 | 10.1021/jm030080s | |||
135367857 | 171383 | 0 | None | -69 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 228 | 1 | 1 | 3 | 2.3 | Cc1ccc(-c2noc3c2CCNCC3)cc1 | 10.1021/acs.jmedchem.8b00642 | |||
CHEMBL4215875 | 171383 | 0 | None | -69 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 228 | 1 | 1 | 3 | 2.3 | Cc1ccc(-c2noc3c2CCNCC3)cc1 | 10.1021/acs.jmedchem.8b00642 | |||
71918568 | 126332 | 4 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 3.0 | O=C(CCCNCc1ccc(Cl)c2cccnc12)NC1CC1 | 10.1021/acs.jmedchem.1c02031 | |||
CHEMBL3459329 | 126332 | 4 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 3.0 | O=C(CCCNCc1ccc(Cl)c2cccnc12)NC1CC1 | 10.1021/acs.jmedchem.1c02031 | |||
44351511 | 26154 | 0 | None | -1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 350 | 5 | 0 | 3 | 4.3 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129230 | 26154 | 0 | None | -1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 350 | 5 | 0 | 3 | 4.3 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
44455980 | 20754 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 175 | 0 | 2 | 3 | 1.5 | CC1(C)NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1196896 | 20754 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 175 | 0 | 2 | 3 | 1.5 | CC1(C)NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL558579 | 20754 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 175 | 0 | 2 | 3 | 1.5 | CC1(C)NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
72550642 | 120855 | 0 | None | -134 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 491 | 10 | 1 | 4 | 5.6 | COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 | 10.1016/j.bmc.2014.07.026 | |||
CHEMBL3326982 | 120855 | 0 | None | -134 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 491 | 10 | 1 | 4 | 5.6 | COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 | 10.1016/j.bmc.2014.07.026 | |||
71918568 | 126332 | 4 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 3.0 | O=C(CCCNCc1ccc(Cl)c2cccnc12)NC1CC1 | 10.1021/acs.jmedchem.1c02031 | |||
CHEMBL3459329 | 126332 | 4 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 3.0 | O=C(CCCNCc1ccc(Cl)c2cccnc12)NC1CC1 | 10.1021/acs.jmedchem.1c02031 | |||
CHEMBL5074821 | 221115 | 1 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | Cc1cnn(C[C@H](C)NCc2cccc(OCc3ccccn3)c2)c1 | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5087322 | 221864 | 6 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | Cc1cnc(NCc2ccccc2-n2ccnc2)nc1N(C)C | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5092728 | 222163 | 1 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)(C)c1ccc2c(c1)CN(C[C@@H](O)COC1CCOCC1)CC2 | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5093652 | 222216 | 2 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | N#CC1(c2ccccc2)CCC(NCCc2nnc3ccccn23)CC1 | 10.1021/acs.jmedchem.1c02031 | |||||
44397618 | 74396 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cn2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL190382 | 74396 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cn2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL5081379 | 221525 | 0 | None | -18 | 9 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | None | None | None | CCCNCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
44351102 | 23784 | 0 | None | 1 | 3 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 4.9 | Cn1c2c(c3ccccc31)CN(CCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL125417 | 23784 | 0 | None | 1 | 3 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 4.9 | Cn1c2c(c3ccccc31)CN(CCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
9817810 | 24144 | 1 | None | -501 | 8 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 300 | 4 | 1 | 4 | 2.4 | NCCc1cccc2c1ccn2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
CHEMBL125745 | 24144 | 1 | None | -501 | 8 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 300 | 4 | 1 | 4 | 2.4 | NCCc1cccc2c1ccn2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
44455963 | 161965 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 215 | 1 | 2 | 3 | 2.5 | CC1NC(NC2CCC2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL402400 | 161965 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 215 | 1 | 2 | 3 | 2.5 | CC1NC(NC2CCC2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
44351183 | 25632 | 0 | None | -5 | 3 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1cccc2c3c(n(C)c12)CCN(CCCOc1ccc(F)cc1)C3 | 10.1021/jm030080s | |||
CHEMBL128184 | 25632 | 0 | None | -5 | 3 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1cccc2c3c(n(C)c12)CCN(CCCOc1ccc(F)cc1)C3 | 10.1021/jm030080s | |||
117209962 | 191648 | 1 | None | -46 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 242 | 2 | 2 | 3 | 1.8 | Cc1ccc(-c2n[nH]cc2N2CCNCC2)cc1 | 10.1021/acs.jmedchem.1c01093 | |||
CHEMBL4852622 | 191648 | 1 | None | -46 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 242 | 2 | 2 | 3 | 1.8 | Cc1ccc(-c2n[nH]cc2N2CCNCC2)cc1 | 10.1021/acs.jmedchem.1c01093 | |||
136118716 | 99834 | 0 | None | 3 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442271 | 99834 | 0 | None | 3 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1 | 10.1016/j.bmc.2013.09.011 | |||
135367820 | 171600 | 0 | None | -23 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 232 | 1 | 1 | 3 | 2.2 | Fc1ccc(-c2noc3c2CCNCC3)cc1 | 10.1021/acs.jmedchem.8b00642 | |||
CHEMBL4218672 | 171600 | 0 | None | -23 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 232 | 1 | 1 | 3 | 2.2 | Fc1ccc(-c2noc3c2CCNCC3)cc1 | 10.1021/acs.jmedchem.8b00642 | |||
136152965 | 102271 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 271 | 3 | 2 | 3 | 3.9 | CC1NC(NCCC2CCCCC2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL257302 | 102271 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 271 | 3 | 2 | 3 | 3.9 | CC1NC(NCCC2CCCCC2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
11443218 | 74252 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 489 | 11 | 2 | 3 | 6.4 | c1ccc(CCNCc2ccc(-c3ccc(CNC4CCN(Cc5ccccc5)CC4)cc3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL189262 | 74252 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 489 | 11 | 2 | 3 | 6.4 | c1ccc(CCNCc2ccc(-c3ccc(CNC4CCN(Cc5ccccc5)CC4)cc3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
24865725 | 194863 | 0 | None | -2511 | 12 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 453 | 8 | 1 | 5 | 4.2 | Cc1ccc2c(OCCN3CCC(Cc4cccc(NS(C)(=O)=O)c4)CC3)cccc2n1 | 10.1021/jm8001444 | |||
CHEMBL497963 | 194863 | 0 | None | -2511 | 12 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 453 | 8 | 1 | 5 | 4.2 | Cc1ccc2c(OCCN3CCC(Cc4cccc(NS(C)(=O)=O)c4)CC3)cccc2n1 | 10.1021/jm8001444 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
136118613 | 99838 | 0 | None | -5 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3cccc(Br)c23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442275 | 99838 | 0 | None | -5 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3cccc(Br)c23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL5087322 | 221864 | 6 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | None | None | None | Cc1cnc(NCc2ccccc2-n2ccnc2)nc1N(C)C | 10.1021/acs.jmedchem.1c02031 | |||||
50923441 | 131927 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 358 | 2 | 2 | 2 | 3.0 | Cc1cc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc2n1 | nan | |||
CHEMBL3644524 | 131927 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 358 | 2 | 2 | 2 | 3.0 | Cc1cc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc2n1 | nan | |||
11121216 | 36912 | 0 | None | -6 | 14 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
CHEMBL138989 | 36912 | 0 | None | -6 | 14 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
10382508 | 214644 | 0 | None | -2 | 3 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030030n | |||
CHEMBL96504 | 214644 | 0 | None | -2 | 3 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030030n | |||
10382508 | 214644 | 0 | None | 2 | 3 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL96504 | 214644 | 0 | None | 2 | 3 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
44351059 | 26201 | 0 | None | - | 1 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 4.6 | Cn1c2c(c3ccccc31)CN(CCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129472 | 26201 | 0 | None | - | 1 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 4.6 | Cn1c2c(c3ccccc31)CN(CCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/acs.jmedchem.6b01422 | |||
136118732 | 83021 | 0 | None | 1 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)NC(=O)/C1=C\c1c[nH]c2c(Br)cccc12 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058409 | 83021 | 0 | None | 1 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)NC(=O)/C1=C\c1c[nH]c2c(Br)cccc12 | 10.1016/j.bmc.2013.09.011 | |||
44351342 | 26203 | 0 | None | 1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 332 | 5 | 0 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129476 | 26203 | 0 | None | 1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 332 | 5 | 0 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccccc1)CC2 | 10.1021/jm030080s | |||
44456251 | 19608 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188516 | 19608 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536561 | 19608 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
44351183 | 25632 | 0 | None | -6 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1cccc2c3c(n(C)c12)CCN(CCCOc1ccc(F)cc1)C3 | 10.1021/jm030080s | |||
CHEMBL128184 | 25632 | 0 | None | -6 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1cccc2c3c(n(C)c12)CCN(CCCOc1ccc(F)cc1)C3 | 10.1021/jm030080s | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmc.2011.08.033 | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmc.2011.08.033 | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmc.2011.08.033 | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmc.2011.08.033 | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmc.2011.08.033 | |||
854531 | 159773 | 30 | None | -1 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 244 | 1 | 1 | 1 | 4.4 | c1ccc(-c2nccc3c2[nH]c2ccccc23)cc1 | 10.1021/acs.jmedchem.0c01887 | |||
CHEMBL3975325 | 159773 | 30 | None | -1 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 244 | 1 | 1 | 1 | 4.4 | c1ccc(-c2nccc3c2[nH]c2ccccc23)cc1 | 10.1021/acs.jmedchem.0c01887 | |||
136118619 | 83026 | 0 | None | -2 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.3 | C/N=C1\NC(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058418 | 83026 | 0 | None | -2 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.3 | C/N=C1\NC(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
44456487 | 19645 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188759 | 19645 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL537248 | 19645 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
136118616 | 83023 | 0 | None | -14 | 5 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.3 | C/N=C1\NC(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058415 | 83023 | 0 | None | -14 | 5 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.3 | C/N=C1\NC(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1C | 10.1016/j.bmc.2013.09.011 | |||
136152963 | 104231 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL270131 | 104231 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
9888494 | 104947 | 0 | None | -660 | 13 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 422 | 4 | 1 | 5 | 3.6 | O=C1c2ccccc2CCCN1CCN1CCC(n2c(O)nc3cc(F)ccc32)CC1 | 10.1016/s0960-894x(03)00077-5 | |||
CHEMBL273921 | 104947 | 0 | None | -660 | 13 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 422 | 4 | 1 | 5 | 3.6 | O=C1c2ccccc2CCCN1CCN1CCC(n2c(O)nc3cc(F)ccc32)CC1 | 10.1016/s0960-894x(03)00077-5 | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
5 | 6927 | 72 | None | -891 | 53 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
5202 | 6927 | 72 | None | -891 | 53 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
CHEMBL39 | 6927 | 72 | None | -891 | 53 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
DB08839 | 6927 | 72 | None | -891 | 53 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
CHEMBL5280298 | 200838 | 0 | None | -1 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 294 | 1 | 1 | 1 | 5.5 | c1ccc2cc(-c3nccc4c3[nH]c3ccccc34)ccc2c1 | 10.1021/acs.jmedchem.0c01887 | |||
53381002 | 72239 | 0 | None | -17 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 240 | 2 | 2 | 4 | 2.2 | COc1cccc2[nH]cc(-c3ccnc(N)n3)c12 | 10.1016/j.bmc.2011.08.033 | |||
CHEMBL1829959 | 72239 | 0 | None | -17 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 240 | 2 | 2 | 4 | 2.2 | COc1cccc2[nH]cc(-c3ccnc(N)n3)c12 | 10.1016/j.bmc.2011.08.033 | |||
136152981 | 104343 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 203 | 2 | 2 | 3 | 2.3 | CCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL270658 | 104343 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 203 | 2 | 2 | 3 | 2.3 | CCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
136118615 | 99840 | 0 | None | -2 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3c(Br)cccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442277 | 99840 | 0 | None | -2 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3c(Br)cccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
44582676 | 196558 | 0 | None | -12 | 17 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 403 | 9 | 0 | 4 | 4.3 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
CHEMBL516088 | 196558 | 0 | None | -12 | 17 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 403 | 9 | 0 | 4 | 4.3 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
24865727 | 199892 | 0 | None | -1000 | 11 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 479 | 7 | 0 | 5 | 4.4 | Cc1ccc2c(OCCN3CCC(Cc4cccc(N5CCCS5(=O)=O)c4)CC3)cccc2n1 | 10.1021/jm8001444 | |||
CHEMBL522708 | 199892 | 0 | None | -1000 | 11 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 479 | 7 | 0 | 5 | 4.4 | Cc1ccc2c(OCCN3CCC(Cc4cccc(N5CCCS5(=O)=O)c4)CC3)cccc2n1 | 10.1021/jm8001444 | |||
10947658 | 35475 | 0 | None | -14 | 16 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
CHEMBL137781 | 35475 | 0 | None | -14 | 16 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/j.bmcl.2013.12.024 | |||
9867475 | 24785 | 0 | None | -524 | 9 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 432 | 7 | 0 | 5 | 4.2 | CN(C)CCc1cccc2c1cc(C(=O)c1ccccc1)n2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
CHEMBL126340 | 24785 | 0 | None | -524 | 9 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 432 | 7 | 0 | 5 | 4.2 | CN(C)CCc1cccc2c1cc(C(=O)c1ccccc1)n2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
108182 | 10903 | 22 | None | -51 | 17 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | 10.1021/jm030030n | |||
245 | 10903 | 22 | None | -51 | 17 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | 10.1021/jm030030n | |||
CHEMBL18041 | 10903 | 22 | None | -51 | 17 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | 10.1021/jm030030n | |||
CHEMBL4802043 | 220836 | 11 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCOc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C#Cc2cnc(C(=O)O)cc2OC)c2ncccc12 | 10.6019/CHEMBL4800726 | |||||
CHEMBL4802043 | 220836 | 11 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCOc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C#Cc2cnc(C(=O)O)cc2OC)c2ncccc12 | 10.6019/CHEMBL4800726 | |||||
136152968 | 162103 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 245 | 2 | 2 | 4 | 2.1 | CC1NC(NC[C@H]2CCCO2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL403102 | 162103 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 245 | 2 | 2 | 4 | 2.1 | CC1NC(NC[C@H]2CCCO2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
44351184 | 25633 | 0 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)c1c(n2C)CCN(CCCOc2ccc(F)cc2)C1 | 10.1021/jm030080s | |||
CHEMBL128185 | 25633 | 0 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)c1c(n2C)CCN(CCCOc2ccc(F)cc2)C1 | 10.1021/jm030080s | |||
10028436 | 10305 | 5 | None | -87 | 12 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1021/jm030030n | |||
3237 | 10305 | 5 | None | -87 | 12 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1021/jm030030n | |||
CHEMBL95104 | 10305 | 5 | None | -87 | 12 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1021/jm030030n | |||
44351342 | 26203 | 0 | None | -1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 332 | 5 | 0 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129476 | 26203 | 0 | None | -1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 332 | 5 | 0 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(=O)c1ccccc1)CC2 | 10.1021/jm030080s | |||
6604756 | 105607 | 18 | None | -28 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 275 | 6 | 0 | 2 | 4.2 | CCCN(CCC)[C@@H]1CCc2c(OC)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
CHEMBL278751 | 105607 | 18 | None | -28 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 275 | 6 | 0 | 2 | 4.2 | CCCN(CCC)[C@@H]1CCc2c(OC)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
44582705 | 193775 | 0 | None | -10 | 13 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 399 | 9 | 0 | 4 | 4.5 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
CHEMBL490632 | 193775 | 0 | None | -10 | 13 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 399 | 9 | 0 | 4 | 4.5 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
13972207 | 126395 | 0 | None | 13 | 2 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 247 | 7 | 0 | 2 | 3.7 | CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL34652 | 126395 | 0 | None | 13 | 2 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 247 | 7 | 0 | 2 | 3.7 | CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
10334023 | 119659 | 5 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 283 | 1 | 2 | 1 | 4.9 | c1ccc2c(-c3nccc4c3[nH]c3ccccc34)c[nH]c2c1 | 10.1021/acs.jmedchem.0c01887 | |||
CHEMBL3309924 | 119659 | 5 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 283 | 1 | 2 | 1 | 4.9 | c1ccc2c(-c3nccc4c3[nH]c3ccccc34)c[nH]c2c1 | 10.1021/acs.jmedchem.0c01887 | |||
CHEMBL5268604 | 200353 | 0 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 299 | 1 | 3 | 2 | 4.6 | Oc1ccc2[nH]c3c(-c4c[nH]c5ccccc45)nccc3c2c1 | 10.1021/acs.jmedchem.0c01887 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm2006782 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm2006782 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm2006782 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm2006782 | |||
71459269 | 89735 | 0 | None | -7413 | 8 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 555 | 7 | 0 | 4 | 6.3 | Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc12 | 10.1021/jm300943r | |||
CHEMBL2181166 | 89735 | 0 | None | -7413 | 8 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 555 | 7 | 0 | 4 | 6.3 | Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc12 | 10.1021/jm300943r | |||
44351063 | 26238 | 0 | None | 1 | 2 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 328 | 3 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CC#CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129774 | 26238 | 0 | None | 1 | 2 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 328 | 3 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CC#CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
44351102 | 23784 | 0 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 4.9 | Cn1c2c(c3ccccc31)CN(CCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL125417 | 23784 | 0 | None | -1 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 4.9 | Cn1c2c(c3ccccc31)CN(CCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
132060776 | 169181 | 0 | None | -5 | 16 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 419 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1CCc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
CHEMBL4165863 | 169181 | 0 | None | -5 | 16 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 419 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1CCc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
136152974 | 102001 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 247 | 5 | 2 | 4 | 2.4 | CCOCCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL256049 | 102001 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 247 | 5 | 2 | 4 | 2.4 | CCOCCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
168268877 | 196749 | 0 | None | -38 | 12 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 328 | 2 | 3 | 3 | 3.8 | COc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1 | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5170784 | 196749 | 0 | None | -38 | 12 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 328 | 2 | 3 | 3 | 3.8 | COc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1 | 10.1021/acsmedchemlett.1c00694 | |||
44351063 | 26238 | 0 | None | -1 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 328 | 3 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CC#CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL129774 | 26238 | 0 | None | -1 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 328 | 3 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CC#CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
25107716 | 9130 | 43 | None | -309 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 466 | 10 | 1 | 4 | 5.2 | N#Cc1ccc(cc1)CNC(=O)CCCCCN1CCN(CC1)c1ccccc1c1ccccc1 | 10.1039/C8MD00313K | |||
8436 | 9130 | 43 | None | -309 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 466 | 10 | 1 | 4 | 5.2 | N#Cc1ccc(cc1)CNC(=O)CCCCCN1CCN(CC1)c1ccccc1c1ccccc1 | 10.1039/C8MD00313K | |||
CHEMBL522691 | 9130 | 43 | None | -309 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 466 | 10 | 1 | 4 | 5.2 | N#Cc1ccc(cc1)CNC(=O)CCCCCN1CCN(CC1)c1ccccc1c1ccccc1 | 10.1039/C8MD00313K | |||
136100333 | 101290 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | CNC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL25163 | 101290 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | CNC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536557 | 101290 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | CNC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
44351193 | 123630 | 0 | None | 1 | 3 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cc(Cl)ccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL338095 | 123630 | 0 | None | 1 | 3 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cc(Cl)ccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL5074880 | 221118 | 0 | None | -186 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCNCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
10028436 | 10305 | 5 | None | -87 | 12 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1016/s0960-894x(02)00690-x | |||
3237 | 10305 | 5 | None | -87 | 12 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1016/s0960-894x(02)00690-x | |||
CHEMBL95104 | 10305 | 5 | None | -87 | 12 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 487 | 7 | 1 | 4 | 4.9 | Clc1ccc(cc1)OC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)[nH]cc2 | 10.1016/s0960-894x(02)00690-x | |||
136118728 | 99836 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3cc(Br)ccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442273 | 99836 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3cc(Br)ccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
44351100 | 178250 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C/CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL446356 | 178250 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C/CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
44355204 | 28672 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL132019 | 28672 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
136152980 | 162058 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 217 | 3 | 2 | 3 | 2.7 | CCCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL402874 | 162058 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 217 | 3 | 2 | 3 | 2.7 | CCCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
11035049 | 175357 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 335 | 5 | 1 | 4 | 3.6 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(N)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL435814 | 175357 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 335 | 5 | 1 | 4 | 3.6 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(N)cc1)CC2 | 10.1021/jm030080s | |||
10924201 | 124943 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 288 | 5 | 0 | 3 | 3.0 | Cn1ccc2c1CCN(CCCOc1ccc(F)cc1)C2 | 10.1021/jm030080s | |||
CHEMBL340861 | 124943 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 288 | 5 | 0 | 3 | 3.0 | Cn1ccc2c1CCN(CCCOc1ccc(F)cc1)C2 | 10.1021/jm030080s | |||
136179599 | 19631 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 189 | 1 | 2 | 3 | 1.9 | CCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL1188681 | 19631 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 189 | 1 | 2 | 3 | 1.9 | CCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL537022 | 19631 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 189 | 1 | 2 | 3 | 1.9 | CCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
75306277 | 116031 | 0 | None | -99 | 23 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 308 | 0 | 0 | 3 | 4.2 | CN1CCC2C(C1)c1cccc3c1N2c1ccccc1CS3 | 10.1039/C2MD00311B | |||
CHEMBL3217984 | 116031 | 0 | None | -99 | 23 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 308 | 0 | 0 | 3 | 4.2 | CN1CCC2C(C1)c1cccc3c1N2c1ccccc1CS3 | 10.1039/C2MD00311B | |||
11168912 | 18142 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 555 | 11 | 1 | 5 | 6.7 | O=C(c1ccc2c(c1)OCO2)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1179769 | 18142 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 555 | 11 | 1 | 5 | 6.7 | O=C(c1ccc2c(c1)OCO2)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL99071 | 18142 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 555 | 11 | 1 | 5 | 6.7 | O=C(c1ccc2c(c1)OCO2)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
44397486 | 73886 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 489 | 11 | 2 | 3 | 6.4 | c1ccc(CCNCc2ccc(-c3cccc(CNC4CCN(Cc5ccccc5)CC4)c3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL187415 | 73886 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 489 | 11 | 2 | 3 | 6.4 | c1ccc(CCNCc2ccc(-c3cccc(CNC4CCN(Cc5ccccc5)CC4)c3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
44456170 | 19923 | 1 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2c(F)cccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1190707 | 19923 | 1 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2c(F)cccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL541394 | 19923 | 1 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2c(F)cccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
155536080 | 178893 | 0 | None | -13 | 10 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 219 | 2 | 1 | 2 | 2.9 | CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N | 10.1021/acsmedchemlett.9b00225 | |||
CHEMBL4472703 | 178893 | 0 | None | -13 | 10 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 219 | 2 | 1 | 2 | 2.9 | CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N | 10.1021/acsmedchemlett.9b00225 | |||
10171 | 6845 | 18 | None | 5 | 6 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 401 | 3 | 1 | 2 | 3.7 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)CC | 10.1021/jm030030n | |||
272 | 6845 | 18 | None | 5 | 6 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 401 | 3 | 1 | 2 | 3.7 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)CC | 10.1021/jm030030n | |||
CHEMBL274384 | 6845 | 18 | None | 5 | 6 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 401 | 3 | 1 | 2 | 3.7 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)CC | 10.1021/jm030030n | |||
16093484 | 104836 | 6 | None | 3 | 6 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL273170 | 104836 | 6 | None | 3 | 6 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
50923724 | 131944 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3ccc(F)cc3F)c2c1 | nan | |||
CHEMBL3644541 | 131944 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3ccc(F)cc3F)c2c1 | nan | |||
CHEMBL5079273 | 221390 | 4 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | Clc1ccc(CNCCc2cccnc2)c2ncccc12 | 10.1021/acs.jmedchem.1c02031 | |||||
91819722 | 133574 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 365 | 1 | 2 | 2 | 2.4 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cncc3F)c2C1 | nan | |||
CHEMBL3654204 | 133574 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 365 | 1 | 2 | 2 | 2.4 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cncc3F)c2C1 | nan | |||
13972256 | 126396 | 1 | None | 1 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 233 | 6 | 1 | 2 | 3.4 | CCCN(CCC)[C@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL34653 | 126396 | 1 | None | 1 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 233 | 6 | 1 | 2 | 3.4 | CCCN(CCC)[C@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
91819720 | 133570 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3ccc(F)cc3F)c2C1 | nan | |||
CHEMBL3654200 | 133570 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 1 | 2 | 1 | 3.0 | NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3ccc(F)cc3F)c2C1 | nan | |||
60150905 | 133579 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 302 | 1 | 2 | 1 | 1.9 | NC(N)=NC(=O)N1Cc2c(C3CC3)ccc(F)c2C2(CC2)C1 | nan | |||
CHEMBL3654209 | 133579 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 302 | 1 | 2 | 1 | 1.9 | NC(N)=NC(=O)N1Cc2c(C3CC3)ccc(F)c2C2(CC2)C1 | nan | |||
136152964 | 201718 | 0 | None | 2 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL541993 | 201718 | 0 | None | 2 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
1809 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
4 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
CHEMBL18840 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
1809 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
4 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
CHEMBL18840 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 10.1021/jm030030n | |||
44327952 | 214823 | 0 | None | -3 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 367 | 5 | 3 | 3 | 2.6 | CC[C@@](C)(CO)CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 | 10.1021/jm030030n | |||
CHEMBL97518 | 214823 | 0 | None | -3 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 367 | 5 | 3 | 3 | 2.6 | CC[C@@](C)(CO)CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 | 10.1021/jm030030n | |||
10872812 | 24885 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 388 | 5 | 0 | 3 | 5.3 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(Cl)c(Cl)c1)CC2 | 10.1021/jm030080s | |||
CHEMBL126897 | 24885 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 388 | 5 | 0 | 3 | 5.3 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(Cl)c(Cl)c1)CC2 | 10.1021/jm030080s | |||
10882775 | 24886 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 354 | 5 | 0 | 3 | 4.7 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(Cl)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126898 | 24886 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 354 | 5 | 0 | 3 | 4.7 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(Cl)cc1)CC2 | 10.1021/jm030080s | |||
1524 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
197 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
3822 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
88 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
CHEMBL51 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
DB12465 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
1524 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
197 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
3822 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
88 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
CHEMBL51 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
DB12465 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm030030n | |||
71452650 | 85271 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C\CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL2111848 | 85271 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C\CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL5082151 | 221567 | 1 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | None | None | None | CN(C)S(=O)(=O)CCNCc1ccc(Cl)c2cccnc12 | 10.1021/acs.jmedchem.1c02031 | |||||
127036932 | 144126 | 0 | None | -69 | 22 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 274 | 7 | 1 | 1 | 4.0 | C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL3752900 | 144126 | 0 | None | -69 | 22 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 274 | 7 | 1 | 1 | 4.0 | C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL5074821 | 221115 | 1 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | None | None | None | Cc1cnn(C[C@H](C)NCc2cccc(OCc3ccccn3)c2)c1 | 10.1021/acs.jmedchem.1c02031 | |||||
2760172 | 105585 | 32 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | c1ccc2cc(N3CCNCC3)ccc2c1 | 10.1021/jm030030n | |||
CHEMBL278509 | 105585 | 32 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | c1ccc2cc(N3CCNCC3)ccc2c1 | 10.1021/jm030030n | |||
CHEMBL5084249 | 221684 | 0 | None | -251 | 8 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CCN(CC)CCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
73346042 | 98609 | 5 | None | -21379 | 17 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 405 | 9 | 0 | 8 | 0.9 | Cn1c(=O)cnn(CCCCN2CCN(c3ccccc3OCCF)CC2)c1=O | 10.1016/j.bmc.2013.05.050 | |||
CHEMBL2413153 | 98609 | 5 | None | -21379 | 17 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 405 | 9 | 0 | 8 | 0.9 | Cn1c(=O)cnn(CCCCN2CCN(c3ccccc3OCCF)CC2)c1=O | 10.1016/j.bmc.2013.05.050 | |||
CHEMBL5092728 | 222163 | 1 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | None | None | None | CC(C)(C)c1ccc2c(c1)CN(C[C@@H](O)COC1CCOCC1)CC2 | 10.1021/acs.jmedchem.1c02031 | |||||
70530 | 103732 | 104 | None | -6 | 3 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 178 | 1 | 2 | 3 | 0.8 | Oc1ccccc1N1CCNCC1 | 10.1021/jm030030n | |||
CHEMBL266250 | 103732 | 104 | None | -6 | 3 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 178 | 1 | 2 | 3 | 0.8 | Oc1ccccc1N1CCNCC1 | 10.1021/jm030030n | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm990550b | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm990550b | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm990550b | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm990550b | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm990550b | |||
136152966 | 102368 | 0 | None | -1 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 289 | 3 | 2 | 4 | 2.9 | COc1c(Cl)ccc2c1C(C)NC(NCC(F)F)=N2 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL257744 | 102368 | 0 | None | -1 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 289 | 3 | 2 | 4 | 2.9 | COc1c(Cl)ccc2c1C(C)NC(NCC(F)F)=N2 | 10.1016/j.bmcl.2007.10.078 | |||
135458427 | 178332 | 0 | None | -5 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 283 | 4 | 2 | 4 | 3.0 | CC(C)Oc1cccc2c1N=C(NCC(F)F)NC2C | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL446459 | 178332 | 0 | None | -5 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 283 | 4 | 2 | 4 | 3.0 | CC(C)Oc1cccc2c1N=C(NCC(F)F)NC2C | 10.1016/j.bmcl.2007.10.078 | |||
44456395 | 102446 | 0 | None | -1 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 225 | 1 | 2 | 4 | 2.0 | COc1c(Cl)ccc2c1C(C)NC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL258073 | 102446 | 0 | None | -1 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 225 | 1 | 2 | 4 | 2.0 | COc1c(Cl)ccc2c1C(C)NC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
134138168 | 154469 | 0 | None | -19 | 10 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 275 | 4 | 0 | 2 | 4.1 | COc1ccccc1-c1cc(CN(C)C)ccc1Cl | 10.1021/acs.jmedchem.1c00110 | |||
CHEMBL3931889 | 154469 | 0 | None | -19 | 10 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 275 | 4 | 0 | 2 | 4.1 | COc1ccccc1-c1cc(CN(C)C)ccc1Cl | 10.1021/acs.jmedchem.1c00110 | |||
4806 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
7351 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
9966051 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
CHEMBL2104993 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
DB09068 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
24841480 | 190678 | 0 | None | -1096 | 20 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 340 | 3 | 0 | 4 | 4.5 | O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
CHEMBL481153 | 190678 | 0 | None | -1096 | 20 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 340 | 3 | 0 | 4 | 4.5 | O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
181743 | 185351 | 5 | None | -1122 | 22 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 339 | 2 | 0 | 5 | 3.2 | COc1cc2c3c(c1OC)-c1cc4c(cc1CC3N(C)CC2)OCO4 | 10.1016/j.bmcl.2009.11.053 | |||
CHEMBL467094 | 185351 | 5 | None | -1122 | 22 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 339 | 2 | 0 | 5 | 3.2 | COc1cc2c3c(c1OC)-c1cc4c(cc1CC3N(C)CC2)OCO4 | 10.1016/j.bmcl.2009.11.053 | |||
CHEMBL4576555 | 220796 | 5 | None | -2 | 19 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL4507307 | |||||
44351180 | 24856 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cccc(Cl)c31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126737 | 24856 | 0 | None | 1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cccc(Cl)c31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
44351077 | 123748 | 0 | None | 1 | 3 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 352 | 5 | 1 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL338696 | 123748 | 0 | None | 1 | 3 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 352 | 5 | 1 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
118464420 | 145023 | 0 | None | -38 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 335 | 1 | 3 | 5 | 2.8 | NC1=NC2(CCCCC2)NC(Nc2cccc(Br)c2)=N1 | 10.1021/acs.jmedchem.5b01631 | |||
CHEMBL3770342 | 145023 | 0 | None | -38 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 335 | 1 | 3 | 5 | 2.8 | NC1=NC2(CCCCC2)NC(Nc2cccc(Br)c2)=N1 | 10.1021/acs.jmedchem.5b01631 | |||
10324985 | 83556 | 8 | None | -169 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
CHEMBL199824 | 83556 | 8 | None | -169 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
CHEMBL2068762 | 83556 | 8 | None | -169 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
168293874 | 198958 | 0 | None | -52 | 11 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 312 | 2 | 3 | 3 | 3.3 | COc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)c(O)c1 | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5204071 | 198958 | 0 | None | -52 | 11 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 312 | 2 | 3 | 3 | 3.3 | COc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)c(O)c1 | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5090584 | 222050 | 2 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CN(C)S(=O)(=O)CCNCc1cccc2cccnc12 | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5071978 | 221051 | 0 | None | -3 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CCN(CC)Cc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
117209858 | 191333 | 1 | None | -147 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 262 | 2 | 2 | 3 | 2.1 | Clc1cccc(-c2n[nH]cc2N2CCNCC2)c1 | 10.1021/acs.jmedchem.1c01093 | |||
CHEMBL4848305 | 191333 | 1 | None | -147 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 262 | 2 | 2 | 3 | 2.1 | Clc1cccc(-c2n[nH]cc2N2CCNCC2)c1 | 10.1021/acs.jmedchem.1c01093 | |||
122334 | 7110 | 23 | None | -51 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 233 | 4 | 1 | 2 | 3.1 | CCCN[C@@H]1CCc2c([C@@H]1C)cccc2OC | 10.1016/S0960-894X(01)80181-5 | |||
970 | 7110 | 23 | None | -51 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 233 | 4 | 1 | 2 | 3.1 | CCCN[C@@H]1CCc2c([C@@H]1C)cccc2OC | 10.1016/S0960-894X(01)80181-5 | |||
CHEMBL27441 | 7110 | 23 | None | -51 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 233 | 4 | 1 | 2 | 3.1 | CCCN[C@@H]1CCc2c([C@@H]1C)cccc2OC | 10.1016/S0960-894X(01)80181-5 | |||
136118614 | 99839 | 0 | None | -25 | 5 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3ccc(Br)cc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442276 | 99839 | 0 | None | -25 | 5 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3ccc(Br)cc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
155770281 | 184526 | 0 | None | -2 | 9 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 517 | 4 | 1 | 2 | 7.6 | CC(=O)N1CCC(c2ccc(-c3cc(C(=O)O)cc4cc(-c5ccc(C(F)(F)F)cc5)ccc34)cc2)CC1 | 10.1021/acs.jmedchem.1c00164 | |||
CHEMBL4642592 | 184526 | 0 | None | -2 | 9 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 517 | 4 | 1 | 2 | 7.6 | CC(=O)N1CCC(c2ccc(-c3cc(C(=O)O)cc4cc(-c5ccc(C(F)(F)F)cc5)ccc34)cc2)CC1 | 10.1021/acs.jmedchem.1c00164 | |||
44355141 | 31418 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL134331 | 31418 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
127036953 | 144293 | 0 | None | -239 | 22 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 318 | 7 | 1 | 1 | 4.1 | C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL3754166 | 144293 | 0 | None | -239 | 22 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 318 | 7 | 1 | 1 | 4.1 | C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
44455986 | 104372 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 175 | 1 | 2 | 3 | 1.7 | CCC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270841 | 104372 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 175 | 1 | 2 | 3 | 1.7 | CCC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL5093342 | 222343 | 0 | None | -28 | 7 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CCCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5095971 | 222343 | 0 | None | -28 | 7 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CCCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5090884 | 222356 | 0 | None | -37 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CCCCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5096072 | 222356 | 0 | None | -37 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CCCCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
136152973 | 102000 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 247 | 5 | 2 | 4 | 2.4 | CCCOCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL256048 | 102000 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 247 | 5 | 2 | 4 | 2.4 | CCCOCCNC1=Nc2ccccc2C(C)N1 | 10.1016/j.bmcl.2007.10.078 | |||
107838 | 104098 | 112 | None | 1 | 2 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 172 | 0 | 2 | 1 | 1.8 | c1ccc2c3c([nH]c2c1)CNCC3 | 10.1021/jm030030n | |||
CHEMBL269236 | 104098 | 112 | None | 1 | 2 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 172 | 0 | 2 | 1 | 1.8 | c1ccc2c3c([nH]c2c1)CNCC3 | 10.1021/jm030030n | |||
CHEMBL4576555 | 220796 | 5 | None | -2 | 19 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL4507307 | |||||
CHEMBL4576555 | 220796 | 5 | None | -2 | 19 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL5212743 | |||||
44351140 | 25813 | 0 | None | 3 | 3 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL128848 | 25813 | 0 | None | 3 | 3 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
11444050 | 18526 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 537 | 13 | 2 | 3 | 7.1 | O=C(CCC1CCCC1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)CC1CCCCN1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181620 | 18526 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 537 | 13 | 2 | 3 | 7.1 | O=C(CCC1CCCC1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)CC1CCCCN1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL185676 | 18526 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 537 | 13 | 2 | 3 | 7.1 | O=C(CCC1CCCC1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)CC1CCCCN1 | 10.1016/j.bmcl.2005.06.024 | |||
9827938 | 18543 | 0 | None | 6 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 517 | 13 | 1 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181680 | 18543 | 0 | None | 6 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 517 | 13 | 1 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL188486 | 18543 | 0 | None | 6 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 517 | 13 | 1 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
11352884 | 73932 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 518 | 13 | 1 | 4 | 5.7 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)nc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL187621 | 73932 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 518 | 13 | 1 | 4 | 5.7 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)nc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
135966709 | 161934 | 4 | None | -10 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 233 | 2 | 2 | 4 | 2.3 | CNC1=Nc2c(OC(C)C)cccc2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL402179 | 161934 | 4 | None | -10 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 233 | 2 | 2 | 4 | 2.3 | CNC1=Nc2c(OC(C)C)cccc2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1021/jm030030n | |||
10893866 | 27080 | 0 | None | 1 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 3.9 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc([N+](=O)[O-])cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL130585 | 27080 | 0 | None | 1 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 3.9 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc([N+](=O)[O-])cc1)CC2 | 10.1021/jm030080s | |||
44351099 | 24827 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 304 | 4 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126574 | 24827 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 304 | 4 | 0 | 2 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
1220 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
31 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
7 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
CHEMBL56 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
1220 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
31 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
7 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
CHEMBL56 | 6975 | 55 | None | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 10.1021/jm030030n | |||
44397593 | 18541 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 553 | 14 | 1 | 4 | 6.1 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)S(=O)(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181677 | 18541 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 553 | 14 | 1 | 4 | 6.1 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)S(=O)(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL188440 | 18541 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 553 | 14 | 1 | 4 | 6.1 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)S(=O)(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
44397513 | 19038 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 523 | 12 | 1 | 3 | 6.5 | CN(C)CCN(Cc1ccc(-c2ccc(CNC3Cc4ccccc4C3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1184719 | 19038 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 523 | 12 | 1 | 3 | 6.5 | CN(C)CCN(Cc1ccc(-c2ccc(CNC3Cc4ccccc4C3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL365422 | 19038 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 523 | 12 | 1 | 3 | 6.5 | CN(C)CCN(Cc1ccc(-c2ccc(CNC3Cc4ccccc4C3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
44455943 | 175781 | 5 | None | 2 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 243 | 1 | 2 | 3 | 3.0 | CCC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL439240 | 175781 | 5 | None | 2 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 243 | 1 | 2 | 3 | 3.0 | CCC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
10472143 | 126055 | 0 | None | -60 | 16 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
CHEMBL343755 | 126055 | 0 | None | -60 | 16 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
44351193 | 123630 | 0 | None | -1 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cc(Cl)ccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL338095 | 123630 | 0 | None | -1 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cc(Cl)ccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL5092524 | 222154 | 2 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CN(C)S(=O)(=O)CCNCc1ccc(F)c2cccnc12 | 10.1021/acs.jmedchem.1c02031 | |||||
44456284 | 19617 | 1 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188595 | 19617 | 1 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536789 | 19617 | 1 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
136152969 | 162104 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 286 | 1 | 2 | 4 | 1.9 | CC1NC(NC2CCCCN(C)C2=O)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL403103 | 162104 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 286 | 1 | 2 | 4 | 1.9 | CC1NC(NC2CCCCN(C)C2=O)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
135458428 | 162313 | 0 | None | 1 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 255 | 3 | 2 | 4 | 2.2 | COc1cccc2c1N=C(NCC(F)F)NC2C | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404248 | 162313 | 0 | None | 1 | 5 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 255 | 3 | 2 | 4 | 2.2 | COc1cccc2c1N=C(NCC(F)F)NC2C | 10.1016/j.bmcl.2007.10.078 | |||
12683497 | 104296 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 175 | 0 | 1 | 3 | 1.3 | CN(C)C1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270409 | 104296 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 175 | 0 | 1 | 3 | 1.3 | CN(C)C1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
4407909 | 199645 | 1 | None | -50 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 356 | 4 | 2 | 4 | 3.6 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(F)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5182943 | 199645 | 1 | None | -50 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 356 | 4 | 2 | 4 | 3.6 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(F)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5221893 | 199645 | 1 | None | -50 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 356 | 4 | 2 | 4 | 3.6 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(F)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
44351077 | 123748 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 5 | 1 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL338696 | 123748 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 5 | 1 | 3 | 4.2 | Cn1c2c(c3ccccc31)CN(CCCC(O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
44374431 | 61726 | 0 | None | -1 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 261 | 4 | 1 | 3 | 2.9 | CCCN[C@@H]1CCc2c(C(=O)OC)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
CHEMBL161507 | 61726 | 0 | None | -1 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 261 | 4 | 1 | 3 | 2.9 | CCCN[C@@H]1CCc2c(C(=O)OC)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
90469115 | 192621 | 4 | None | -954 | 17 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 410 | 3 | 1 | 6 | 3.0 | O=S(=O)(c1cccc(F)c1)n1ccc2c(N3CCNCC3)nc3ccccc3c21 | 10.1021/acs.jmedchem.1c00224 | |||
CHEMBL4867565 | 192621 | 4 | None | -954 | 17 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 410 | 3 | 1 | 6 | 3.0 | O=S(=O)(c1cccc(F)c1)n1ccc2c(N3CCNCC3)nc3ccccc3c21 | 10.1021/acs.jmedchem.1c00224 | |||
CHEMBL5093652 | 222216 | 2 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | N#CC1(c2ccccc2)CCC(NCCc2nnc3ccccn23)CC1 | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5094493 | 222278 | 0 | None | -144 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CCCN(CCC)CCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
44351171 | 123627 | 0 | None | 2 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL338081 | 123627 | 0 | None | 2 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOCc1ccccc1)CC2 | 10.1021/jm030080s | |||
44275750 | 99988 | 39 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 228 | 1 | 2 | 3 | 2.0 | Oc1ccc2cccc(N3CCNCC3)c2c1 | 10.1021/jm030030n | |||
CHEMBL24462 | 99988 | 39 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 228 | 1 | 2 | 3 | 2.0 | Oc1ccc2cccc(N3CCNCC3)c2c1 | 10.1021/jm030030n | |||
CHEMBL5075486 | 221155 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | O=S1(=O)CCC[C@@H](CNCc2ccc(Cl)c3cccnc23)C1 | 10.1021/acs.jmedchem.1c02031 | |||||
50923584 | 131936 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 2 | 2 | 2 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3F)c2c1 | nan | |||
CHEMBL3644533 | 131936 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 2 | 2 | 2 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3F)c2c1 | nan | |||
50923585 | 131937 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 342 | 2 | 2 | 2 | 3.1 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3Cl)c2c1 | nan | |||
CHEMBL3644534 | 131937 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 342 | 2 | 2 | 2 | 3.1 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3Cl)c2c1 | nan | |||
91819719 | 133566 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 348 | 1 | 2 | 1 | 2.5 | NC(N)=NC(=O)N1CCc2cccc(-c3cc(F)c(F)cc3F)c2C1 | nan | |||
CHEMBL3654196 | 133566 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 348 | 1 | 2 | 1 | 2.5 | NC(N)=NC(=O)N1CCc2cccc(-c3cc(F)c(F)cc3F)c2C1 | nan | |||
60150903 | 133581 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 1 | 2 | 1 | 2.7 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3cc(F)c(F)cc3F)c2C1 | nan | |||
CHEMBL3654211 | 133581 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 1 | 2 | 1 | 2.7 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3cc(F)c(F)cc3F)c2C1 | nan | |||
50923581 | 131929 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 372 | 2 | 2 | 2 | 3.4 | Cc1nc2ccc(C(=O)N=C(N)N)cc2c(-c2c(F)cc(F)cc2F)c1C | nan | |||
CHEMBL3644526 | 131929 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 372 | 2 | 2 | 2 | 3.4 | Cc1nc2ccc(C(=O)N=C(N)N)cc2c(-c2c(F)cc(F)cc2F)c1C | nan | |||
60150900 | 133573 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 345 | 1 | 2 | 2 | 2.1 | Cc1ccc(-c2ncc(F)cc2F)c2c1CCN(C(=O)N=C(N)N)C2 | nan | |||
CHEMBL3654203 | 133573 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 345 | 1 | 2 | 2 | 2.1 | Cc1ccc(-c2ncc(F)cc2F)c2c1CCN(C(=O)N=C(N)N)C2 | nan | |||
24936155 | 101397 | 0 | None | -501 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 508 | 4 | 2 | 3 | 5.1 | CC(=O)N1C2C=C(CN3C4CCC3CC(NC(=O)Nc3cc(F)cc(C(F)(F)F)c3)C4)CC1CCC2 | 10.1016/j.bmcl.2007.10.109 | |||
CHEMBL252258 | 101397 | 0 | None | -501 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 508 | 4 | 2 | 3 | 5.1 | CC(=O)N1C2C=C(CN3C4CCC3CC(NC(=O)Nc3cc(F)cc(C(F)(F)F)c3)C4)CC1CCC2 | 10.1016/j.bmcl.2007.10.109 | |||
44374648 | 126750 | 0 | None | -18 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 351 | 5 | 1 | 4 | 3.3 | CCCN[C@@H]1CCc2c(OS(=O)(=O)C(F)(F)F)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
CHEMBL349843 | 126750 | 0 | None | -18 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 351 | 5 | 1 | 4 | 3.3 | CCCN[C@@H]1CCc2c(OS(=O)(=O)C(F)(F)F)cccc2[C@@H]1C | 10.1016/S0960-894X(01)80181-5 | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/acs.jnatprod.0c00793 | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/acs.jnatprod.0c00793 | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/acs.jnatprod.0c00793 | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 10.1021/acs.jnatprod.0c00793 | |||
11272242 | 18534 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccn3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181641 | 18534 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccn3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL186849 | 18534 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccn3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
11364267 | 74313 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)nc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL189689 | 74313 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 512 | 14 | 1 | 4 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)nc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
44355165 | 123248 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL336124 | 123248 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
10287730 | 10309 | 40 | None | -3981 | 12 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 412 | 6 | 0 | 5 | 4.3 | Cc1ccc2c(n1)cccc2OCCN1CCN(CC1)Cc1cccc2c1nccc2 | 10.1021/jm049039v | |||
77 | 10309 | 40 | None | -3981 | 12 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 412 | 6 | 0 | 5 | 4.3 | Cc1ccc2c(n1)cccc2OCCN1CCN(CC1)Cc1cccc2c1nccc2 | 10.1021/jm049039v | |||
CHEMBL425190 | 10309 | 40 | None | -3981 | 12 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 412 | 6 | 0 | 5 | 4.3 | Cc1ccc2c(n1)cccc2OCCN1CCN(CC1)Cc1cccc2c1nccc2 | 10.1021/jm049039v | |||
44397511 | 18540 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 407 | 10 | 1 | 3 | 4.7 | CN(C)CCN(Cc1ccc(-c2ccc(CN)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181669 | 18540 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 407 | 10 | 1 | 3 | 4.7 | CN(C)CCN(Cc1ccc(-c2ccc(CN)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL188050 | 18540 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 407 | 10 | 1 | 3 | 4.7 | CN(C)CCN(Cc1ccc(-c2ccc(CN)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
107838 | 104098 | 112 | None | -1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 172 | 0 | 2 | 1 | 1.8 | c1ccc2c3c([nH]c2c1)CNCC3 | 10.1021/jm030080s | |||
CHEMBL269236 | 104098 | 112 | None | -1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 172 | 0 | 2 | 1 | 1.8 | c1ccc2c3c([nH]c2c1)CNCC3 | 10.1021/jm030080s | |||
127036186 | 144192 | 0 | None | -102 | 19 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 254 | 7 | 1 | 1 | 3.7 | C=CCN(CC=C)CCc1c[nH]c2ccc(C)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL3753318 | 144192 | 0 | None | -102 | 19 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 254 | 7 | 1 | 1 | 3.7 | C=CCN(CC=C)CCc1c[nH]c2ccc(C)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
216239 | 30567 | 118 | None | -6 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | 10.1021/jm300338m | |||
CHEMBL1200485 | 30567 | 118 | None | -6 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | 10.1021/jm300338m | |||
CHEMBL1336 | 30567 | 118 | None | -6 | 7 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | 10.1021/jm300338m | |||
136116062 | 104456 | 0 | None | 2 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2c(Cl)ccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL271253 | 104456 | 0 | None | 2 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2c(Cl)ccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
71452650 | 85271 | 0 | None | -1 | 3 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C\CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL2111848 | 85271 | 0 | None | -1 | 3 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C\CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
50878551 | 97520 | 61 | None | -85 | 18 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL2391541 | 97520 | 61 | None | -85 | 18 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
136118651 | 83099 | 0 | None | -9 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.0 | C/N=C1\NC(=O)/C(=C/c2c[nH]c3c(Br)cccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058706 | 83099 | 0 | None | -9 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.0 | C/N=C1\NC(=O)/C(=C/c2c[nH]c3c(Br)cccc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
10892139 | 172366 | 0 | None | -1 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 306 | 5 | 1 | 2 | 4.0 | c1ccc(OCCCN2CCc3c([nH]c4ccccc34)C2)cc1 | 10.1021/jm030080s | |||
CHEMBL424258 | 172366 | 0 | None | -1 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 306 | 5 | 1 | 2 | 4.0 | c1ccc(OCCCN2CCc3c([nH]c4ccccc34)C2)cc1 | 10.1021/jm030080s | |||
122483275 | 144888 | 0 | None | -15 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 427 | 6 | 1 | 5 | 5.1 | O=C(CCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3764133 | 144888 | 0 | None | -15 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 427 | 6 | 1 | 5 | 5.1 | O=C(CCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3765875 | 144888 | 0 | None | -15 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 427 | 6 | 1 | 5 | 5.1 | O=C(CCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
136118648 | 83096 | 0 | None | -67 | 5 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.0 | C/N=C1\NC(=O)/C(=C/c2c[nH]c3cccc(Br)c23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058703 | 83096 | 0 | None | -67 | 5 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.0 | C/N=C1\NC(=O)/C(=C/c2c[nH]c3cccc(Br)c23)N1 | 10.1016/j.bmc.2013.09.011 | |||
44351361 | 24740 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 365 | 5 | 1 | 4 | 4.3 | Cn1c2c(c3ccccc31)CN(CCC/C(=N/O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126138 | 24740 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 365 | 5 | 1 | 4 | 4.3 | Cn1c2c(c3ccccc31)CN(CCC/C(=N/O)c1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
9862256 | 213899 | 0 | None | -2238 | 9 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 328 | 5 | 0 | 4 | 3.0 | CN(C)CCc1cccc2c1ccn2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
CHEMBL92139 | 213899 | 0 | None | -2238 | 9 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 328 | 5 | 0 | 4 | 3.0 | CN(C)CCc1cccc2c1ccn2S(=O)(=O)c1ccccc1 | 10.1021/jm010943m | |||
10035245 | 36467 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cc(Cl)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL13864 | 36467 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cc(Cl)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL538340 | 36467 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cc(Cl)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
10926167 | 124871 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 350 | 6 | 0 | 4 | 4.0 | COc1ccc(OCCCN2CCc3c(c4ccccc4n3C)C2)cc1 | 10.1021/jm030080s | |||
CHEMBL340646 | 124871 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 350 | 6 | 0 | 4 | 4.0 | COc1ccc(OCCCN2CCc3c(c4ccccc4n3C)C2)cc1 | 10.1021/jm030080s | |||
44351100 | 178250 | 0 | None | -1 | 3 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C/CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL446356 | 178250 | 0 | None | -1 | 3 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 330 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(C/C=C/CCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL5094680 | 222289 | 0 | None | -23 | 8 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | None | None | None | CCCCNCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
11726973 | 24873 | 0 | None | 1 | 3 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CCN(CCCOc1ccccc1)C2 | 10.1021/jm030080s | |||
CHEMBL126823 | 24873 | 0 | None | 1 | 3 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CCN(CCCOc1ccccc1)C2 | 10.1021/jm030080s | |||
136152970 | 102131 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 309 | 2 | 2 | 5 | 2.8 | CC1NC(NCC2COc3ccccc3O2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL256693 | 102131 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 309 | 2 | 2 | 5 | 2.8 | CC1NC(NCC2COc3ccccc3O2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
44355425 | 30360 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL133433 | 30360 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
44455985 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL1190709 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL541396 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
44455985 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1190709 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL541396 | 19924 | 1 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.3 | CC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL5074190 | 221093 | 0 | None | -151 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | None | None | None | COc1ccccc1-c1cc(CCN(C)C)ccc1Cl | 10.1021/acs.jmedchem.1c00110 | |||||
44355426 | 30951 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL133935 | 30951 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
752521 | 205516 | 8 | None | -19 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 295 | 1 | 3 | 5 | 1.9 | CC1(C)N=C(N)N=C(Nc2cccc(Br)c2)N1 | 10.1021/acs.jmedchem.5b01631 | |||
CHEMBL582877 | 205516 | 8 | None | -19 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 295 | 1 | 3 | 5 | 1.9 | CC1(C)N=C(N)N=C(Nc2cccc(Br)c2)N1 | 10.1021/acs.jmedchem.5b01631 | |||
136152978 | 102301 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 207 | 2 | 2 | 3 | 1.9 | CC1NC(NCCF)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL257450 | 102301 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 207 | 2 | 2 | 3 | 1.9 | CC1NC(NCCF)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
44397435 | 18535 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 506 | 12 | 2 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181643 | 18535 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 506 | 12 | 2 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL187029 | 18535 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 506 | 12 | 2 | 3 | 6.3 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL5089996 | 222014 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CN1CC[C@H](CNCc2ccc(Cl)c3cccnc23)CC1=O | 10.1021/acs.jmedchem.1c02031 | |||||
50923444 | 131932 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccc(F)cc3Cl)c2c1 | nan | |||
CHEMBL3644529 | 131932 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 360 | 2 | 2 | 2 | 3.2 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccc(F)cc3Cl)c2c1 | nan | |||
91819724 | 133583 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 331 | 1 | 2 | 2 | 1.8 | NC(N)=NC(=O)N1CCc2cccc(-c3ncc(F)cc3F)c2C1 | nan | |||
CHEMBL3654213 | 133583 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 331 | 1 | 2 | 2 | 1.8 | NC(N)=NC(=O)N1CCc2cccc(-c3ncc(F)cc3F)c2C1 | nan | |||
91819718 | 133565 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 365 | 1 | 2 | 2 | 2.4 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3F)c2C1 | nan | |||
CHEMBL3654195 | 133565 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 365 | 1 | 2 | 2 | 2.4 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3F)c2C1 | nan | |||
50923722 | 131942 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 376 | 3 | 2 | 2 | 3.5 | NC(N)=NC(=O)c1ccc2c(C(F)F)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
CHEMBL3644539 | 131942 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 376 | 3 | 2 | 2 | 3.5 | NC(N)=NC(=O)c1ccc2c(C(F)F)cnc(-c3c(F)cccc3F)c2c1 | nan | |||
50923719 | 131939 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 361 | 2 | 2 | 3 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3Cl)c2c1 | nan | |||
CHEMBL3644536 | 131939 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 361 | 2 | 2 | 3 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3Cl)c2c1 | nan | |||
16093485 | 161842 | 0 | None | -1 | 5 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 239 | 1 | 2 | 4 | 2.3 | COc1cc(Cl)c(C)c2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL401745 | 161842 | 0 | None | -1 | 5 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 239 | 1 | 2 | 4 | 2.3 | COc1cc(Cl)c(C)c2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
13972211 | 145715 | 1 | None | 28 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 233 | 6 | 1 | 2 | 3.4 | CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL37844 | 145715 | 1 | None | 28 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 233 | 6 | 1 | 2 | 3.4 | CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
1342 | 6824 | 49 | None | -16 | 19 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
3 | 6824 | 49 | None | -16 | 19 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
CHEMBL277120 | 6824 | 49 | None | -16 | 19 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm030030n | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm030030n | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm030030n | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm030030n | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1021/jm030030n | |||
1342 | 6824 | 49 | None | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
3 | 6824 | 49 | None | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
CHEMBL277120 | 6824 | 49 | None | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | 10.1021/jm030030n | |||
11808247 | 24847 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1021/jm030080s | |||
CHEMBL126667 | 24847 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1021/jm030080s | |||
CHEMBL3819366 | 24847 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1021/jm030080s | |||
9927441 | 214173 | 0 | None | -1174 | 9 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 328 | 5 | 0 | 4 | 3.0 | CN(C)CCc1cn(S(=O)(=O)c2ccccc2)c2ccccc12 | 10.1021/jm010943m | |||
CHEMBL93868 | 214173 | 0 | None | -1174 | 9 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 328 | 5 | 0 | 4 | 3.0 | CN(C)CCc1cn(S(=O)(=O)c2ccccc2)c2ccccc12 | 10.1021/jm010943m | |||
44455962 | 176125 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL441896 | 176125 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | C[C@H]1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
145980271 | 173271 | 0 | None | -8 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 538 | 8 | 1 | 3 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
CHEMBL4278465 | 173271 | 0 | None | -8 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 538 | 8 | 1 | 3 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
92042876 | 158115 | 0 | None | -79 | 10 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 261 | 4 | 1 | 2 | 3.7 | CNCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||
CHEMBL3961059 | 158115 | 0 | None | -79 | 10 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 261 | 4 | 1 | 2 | 3.7 | CNCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||
127026052 | 144331 | 0 | None | -257 | 19 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 258 | 7 | 1 | 1 | 3.5 | C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
CHEMBL3754496 | 144331 | 0 | None | -257 | 19 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 258 | 7 | 1 | 1 | 3.5 | C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
9904281 | 54523 | 28 | None | 4 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 215 | 0 | 2 | 3 | 2.0 | NC1=Nc2ccc(Cl)c(Cl)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1548 | 54523 | 28 | None | 4 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 215 | 0 | 2 | 3 | 2.0 | NC1=Nc2ccc(Cl)c(Cl)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
44355180 | 172113 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 233 | 6 | 0 | 2 | 3.1 | CCN(CC)C[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL423527 | 172113 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 233 | 6 | 0 | 2 | 3.1 | CCN(CC)C[C@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
44351101 | 23721 | 0 | None | 1 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 346 | 7 | 0 | 2 | 5.3 | Cn1c2c(c3ccccc31)CN(CCCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL125361 | 23721 | 0 | None | 1 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 346 | 7 | 0 | 2 | 5.3 | Cn1c2c(c3ccccc31)CN(CCCCCCc1ccccc1)CC2 | 10.1021/jm030080s | |||
9796627 | 103428 | 0 | None | -154 | 7 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 308 | 4 | 1 | 4 | 3.1 | CN(C)CCc1cn(C(=O)c2ccccc2)c2ccc(O)cc12 | 10.1021/jm010943m | |||
CHEMBL263700 | 103428 | 0 | None | -154 | 7 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 308 | 4 | 1 | 4 | 3.1 | CN(C)CCc1cn(C(=O)c2ccccc2)c2ccc(O)cc12 | 10.1021/jm010943m | |||
3649661 | 144997 | 7 | None | -63 | 8 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 329 | 3 | 3 | 7 | 2.2 | CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
CHEMBL3770106 | 144997 | 7 | None | -63 | 8 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 329 | 3 | 3 | 7 | 2.2 | CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
12 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10.1021/jm990550b | |||
6918513 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10.1021/jm990550b | |||
CHEMBL267615 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10.1021/jm990550b | |||
44456246 | 19604 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188440 | 19604 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536335 | 19604 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
44456400 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL1188501 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL2436555 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL536539 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
136118660 | 83031 | 0 | None | -3 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3cc(Br)ccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058428 | 83031 | 0 | None | -3 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3cc(Br)ccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
145963830 | 170902 | 0 | None | -46 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 335 | 4 | 2 | 4 | 4.0 | Oc1ccccc1C1=NC(Cc2c[nH]cn2)C(c2ccccc2)S1 | 10.1021/acs.jnatprod.7b00317 | |||
CHEMBL4209942 | 170902 | 0 | None | -46 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 335 | 4 | 2 | 4 | 4.0 | Oc1ccccc1C1=NC(Cc2c[nH]cn2)C(c2ccccc2)S1 | 10.1021/acs.jnatprod.7b00317 | |||
136152976 | 174250 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 243 | 1 | 2 | 3 | 2.5 | CC1NC(NCC(F)(F)F)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL429925 | 174250 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 243 | 1 | 2 | 3 | 2.5 | CC1NC(NCC(F)(F)F)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
145986752 | 174055 | 0 | None | -12 | 17 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 562 | 10 | 1 | 5 | 7.3 | COc1ccc(N(CCCCN2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)c2ccc(OC)cc2)cc1 | 10.1016/j.bmcl.2018.10.036 | |||
CHEMBL4293307 | 174055 | 0 | None | -12 | 17 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 562 | 10 | 1 | 5 | 7.3 | COc1ccc(N(CCCCN2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)c2ccc(OC)cc2)cc1 | 10.1016/j.bmcl.2018.10.036 | |||
122483281 | 144886 | 0 | None | 6 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 7 | 0 | 5 | 5.4 | COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc32)CC1 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3763779 | 144886 | 0 | None | 6 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 7 | 0 | 5 | 5.4 | COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc32)CC1 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3765873 | 144886 | 0 | None | 6 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 7 | 0 | 5 | 5.4 | COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc32)CC1 | 10.1016/j.ejmech.2016.01.043 | |||
16006492 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL270177 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
44397364 | 129938 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 518 | 13 | 1 | 4 | 5.7 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cn2)cc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL361256 | 129938 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 518 | 13 | 1 | 4 | 5.7 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cn2)cc1)C(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
16006492 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270177 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
16006492 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270177 | 104245 | 7 | None | 3 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
50923582 | 131934 | 2 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 345 | 2 | 2 | 3 | 2.1 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3F)c2c1 | nan | |||
CHEMBL3644531 | 131934 | 2 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 345 | 2 | 2 | 3 | 2.1 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3F)c2c1 | nan | |||
135458410 | 173968 | 0 | None | 3 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL429136 | 173968 | 0 | None | 3 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
11191906 | 18539 | 0 | None | 6 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 537 | 12 | 1 | 3 | 7.3 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181665 | 18539 | 0 | None | 6 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 537 | 12 | 1 | 3 | 7.3 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL187928 | 18539 | 0 | None | 6 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 537 | 12 | 1 | 3 | 7.3 | O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)Cc1cccnc1 | 10.1016/j.bmcl.2005.06.024 | |||
4713248 | 214686 | 3 | None | -5 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 281 | 5 | 2 | 3 | 1.2 | CNS(=O)(=O)c1ccc2[nH]cc(CCN(C)C)c2c1 | 10.1021/jm030030n | |||
CHEMBL96729 | 214686 | 3 | None | -5 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 281 | 5 | 2 | 3 | 1.2 | CNS(=O)(=O)c1ccc2[nH]cc(CCN(C)C)c2c1 | 10.1021/jm030030n | |||
4713248 | 214686 | 3 | None | -5 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 281 | 5 | 2 | 3 | 1.2 | CNS(=O)(=O)c1ccc2[nH]cc(CCN(C)C)c2c1 | 10.1021/jm030030n | |||
CHEMBL96729 | 214686 | 3 | None | -5 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 281 | 5 | 2 | 3 | 1.2 | CNS(=O)(=O)c1ccc2[nH]cc(CCN(C)C)c2c1 | 10.1021/jm030030n | |||
44397427 | 18528 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 580 | 14 | 1 | 3 | 8.0 | COc1cccc(CCN(Cc2ccc(-c3ccc(CNCCc4ccccc4)cc3)cc2)C(=O)/C=C/c2ccccc2)c1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181625 | 18528 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 580 | 14 | 1 | 3 | 8.0 | COc1cccc(CCN(Cc2ccc(-c3ccc(CNCCc4ccccc4)cc3)cc2)C(=O)/C=C/c2ccccc2)c1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL185996 | 18528 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 580 | 14 | 1 | 3 | 8.0 | COc1cccc(CCN(Cc2ccc(-c3ccc(CNCCc4ccccc4)cc3)cc2)C(=O)/C=C/c2ccccc2)c1 | 10.1016/j.bmcl.2005.06.024 | |||
44456400 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL1188501 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL2436555 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
CHEMBL536539 | 19606 | 0 | None | -2 | 10 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2013.08.072 | |||
136152972 | 101999 | 0 | None | -2 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL256047 | 101999 | 0 | None | -2 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
44355128 | 125260 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 219 | 5 | 1 | 2 | 2.8 | CCN(CC)C[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL341373 | 125260 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 219 | 5 | 1 | 2 | 2.8 | CCN(CC)C[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
136118658 | 83029 | 0 | None | -5 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058426 | 83029 | 0 | None | -5 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3cccc(Br)c23)N1C | 10.1016/j.bmc.2013.09.011 | |||
379995 | 123629 | 2 | None | - | 1 | Mouse | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 336 | 5 | 1 | 2 | 4.3 | O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccc(F)cc1 | 10.1021/jm030080s | |||
CHEMBL338091 | 123629 | 2 | None | - | 1 | Mouse | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 336 | 5 | 1 | 2 | 4.3 | O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccc(F)cc1 | 10.1021/jm030080s | |||
CHEMBL4748908 | 220814 | 1 | None | -64 | 12 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | None | None | None | CN1CCN(c2ccnc(NCCc3ccccc3)n2)CC1 | 10.6019/CHEMBL4800732 | |||||
6918515 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10.1021/jm990550b | |||
71 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10.1021/jm990550b | |||
CHEMBL7318 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10.1021/jm990550b | |||
72550645 | 120866 | 0 | None | -72 | 8 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 505 | 11 | 1 | 4 | 6.0 | COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 | 10.1016/j.bmc.2014.07.026 | |||
CHEMBL3326993 | 120866 | 0 | None | -72 | 8 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 505 | 11 | 1 | 4 | 6.0 | COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 | 10.1016/j.bmc.2014.07.026 | |||
18677411 | 214023 | 11 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 186 | 0 | 1 | 2 | 1.8 | Cn1c2c(c3ccccc31)CNCC2 | 10.1021/jm030080s | |||
CHEMBL92879 | 214023 | 11 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 186 | 0 | 1 | 2 | 1.8 | Cn1c2c(c3ccccc31)CNCC2 | 10.1021/jm030080s | |||
18677411 | 214023 | 11 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 186 | 0 | 1 | 2 | 1.8 | Cn1c2c(c3ccccc31)CNCC2 | 10.1021/jm030030n | |||
CHEMBL92879 | 214023 | 11 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 186 | 0 | 1 | 2 | 1.8 | Cn1c2c(c3ccccc31)CNCC2 | 10.1021/jm030030n | |||
135474338 | 196050 | 0 | None | -28 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3cc(Br)ccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL511879 | 196050 | 0 | None | -28 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 318 | 1 | 3 | 2 | 2.3 | CN1C(=N)N/C(=C/c2c[nH]c3cc(Br)ccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
10382508 | 214644 | 0 | None | -2 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030030n | |||
CHEMBL96504 | 214644 | 0 | None | -2 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030030n | |||
10382508 | 214644 | 0 | None | -2 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL96504 | 214644 | 0 | None | -2 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 338 | 5 | 0 | 3 | 4.1 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
11045379 | 26143 | 0 | None | -4 | 2 | Mouse | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 318 | 5 | 1 | 2 | 4.2 | O=C(CCCN1CCc2c([nH]c3ccccc23)C1)c1ccccc1 | 10.1021/jm030080s | |||
CHEMBL129163 | 26143 | 0 | None | -4 | 2 | Mouse | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 318 | 5 | 1 | 2 | 4.2 | O=C(CCCN1CCc2c([nH]c3ccccc23)C1)c1ccccc1 | 10.1021/jm030080s | |||
44456443 | 19763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cccc(F)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1189631 | 19763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cccc(F)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL539103 | 19763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cccc(F)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
16573 | 184398 | 34 | None | -28 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 341 | 3 | 1 | 5 | 3.2 | COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CCN1C | 10.1021/np500893h | |||
CHEMBL464099 | 184398 | 34 | None | -28 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 341 | 3 | 1 | 5 | 3.2 | COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CCN1C | 10.1021/np500893h | |||
CHEMBL5085238 | 221737 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | O=S1(=O)CC[C@@H](CNCc2cccc3cccnc23)C1 | 10.1021/acs.jmedchem.1c02031 | |||||
44355424 | 28798 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL132123 | 28798 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(O)c1 | 10.1016/0960-894X(96)00045-5 | |||
71462776 | 89738 | 0 | None | -4786 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 460 | 5 | 0 | 3 | 5.5 | CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1 | 10.1021/jm300943r | |||
CHEMBL2181169 | 89738 | 0 | None | -4786 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 460 | 5 | 0 | 3 | 5.5 | CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1 | 10.1021/jm300943r | |||
44351180 | 24856 | 0 | None | -2 | 3 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cccc(Cl)c31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126737 | 24856 | 0 | None | -2 | 3 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 372 | 5 | 0 | 3 | 4.8 | Cn1c2c(c3cccc(Cl)c31)CN(CCCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
118464425 | 145087 | 0 | None | -15 | 9 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 357 | 3 | 2 | 7 | 2.8 | CCOC(=O)c1cccc(NC2=NC(N(C)C)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
CHEMBL3770981 | 145087 | 0 | None | -15 | 9 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 357 | 3 | 2 | 7 | 2.8 | CCOC(=O)c1cccc(NC2=NC(N(C)C)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
50923721 | 131941 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 361 | 2 | 2 | 3 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ncc(F)cc3Cl)c2c1 | nan | |||
CHEMBL3644538 | 131941 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 361 | 2 | 2 | 3 | 2.6 | NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ncc(F)cc3Cl)c2c1 | nan | |||
135458394 | 104467 | 5 | None | 2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 243 | 0 | 2 | 3 | 2.9 | CNC1=Nc2ccc(Cl)c(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL271298 | 104467 | 5 | None | 2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 243 | 0 | 2 | 3 | 2.9 | CNC1=Nc2ccc(Cl)c(Cl)c2C(C)N1 | 10.1016/j.bmcl.2007.10.080 | |||
16006606 | 164440 | 3 | None | 1 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 191 | 1 | 2 | 4 | 1.3 | COc1cccc2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL408152 | 164440 | 3 | None | 1 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 191 | 1 | 2 | 4 | 1.3 | COc1cccc2c1N=C(N)NC2C | 10.1016/j.bmcl.2007.10.080 | |||
135458393 | 162375 | 4 | None | 2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404511 | 162375 | 4 | None | 2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
11168182 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 10.1016/j.bmcl.2005.06.024 | |||
264 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181770 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 10.1016/j.bmcl.2005.06.024 | |||
16006605 | 104768 | 3 | None | -2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2c(Cl)ccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL272781 | 104768 | 3 | None | -2 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2c(Cl)ccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
91819721 | 133572 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 1 | 2 | 1 | 3.5 | NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(Cl)c2C(F)C1 | nan | |||
CHEMBL3654202 | 133572 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 1 | 2 | 1 | 3.5 | NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(Cl)c2C(F)C1 | nan | |||
CHEMBL5093969 | 222240 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | None | None | None | Clc1ccc(CNCC[C@@H]2CCOC2)c2ncccc12 | 10.1021/acs.jmedchem.1c02031 | |||||
CHEMBL5094012 | 222242 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | None | None | None | O=C1C[C@H](CNCc2ccc(Cl)c3cccnc23)CN1C1CC1 | 10.1021/acs.jmedchem.1c02031 | |||||
136152964 | 201718 | 0 | None | -2 | 8 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL541993 | 201718 | 0 | None | -2 | 8 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 259 | 2 | 2 | 3 | 2.8 | C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
60150899 | 133571 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 349 | 1 | 2 | 2 | 1.9 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(F)cc3F)c2C1 | nan | |||
CHEMBL3654201 | 133571 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 349 | 1 | 2 | 2 | 1.9 | NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(F)cc3F)c2C1 | nan | |||
22980542 | 24803 | 0 | None | -3 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 306 | 5 | 1 | 2 | 4.0 | c1ccc(OCCCN2CCc3[nH]c4ccccc4c3C2)cc1 | 10.1021/jm030080s | |||
CHEMBL126438 | 24803 | 0 | None | -3 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 306 | 5 | 1 | 2 | 4.0 | c1ccc(OCCCN2CCc3[nH]c4ccccc4c3C2)cc1 | 10.1021/jm030080s | |||
73353884 | 99097 | 0 | None | -5 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | c1cc2c(cc1CN[C@H]1C3C4CC5C6C4CC3C6C51)OCO2 | 10.1016/j.bmc.2013.07.045 | |||
CHEMBL2429890 | 99097 | 0 | None | -5 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | c1cc2c(cc1CN[C@H]1C3C4CC5C6C4CC3C6C51)OCO2 | 10.1016/j.bmc.2013.07.045 | |||
CHEMBL4748908 | 220814 | 1 | None | -64 | 12 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | CN1CCN(c2ccnc(NCCc3ccccc3)n2)CC1 | 10.6019/CHEMBL4800732 | |||||
11726973 | 24873 | 0 | None | -1 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CCN(CCCOc1ccccc1)C2 | 10.1021/jm030080s | |||
CHEMBL126823 | 24873 | 0 | None | -1 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 320 | 5 | 0 | 3 | 4.0 | Cn1c2c(c3ccccc31)CCN(CCCOc1ccccc1)C2 | 10.1021/jm030080s | |||
146025727 | 178464 | 0 | None | -229 | 27 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 411 | 3 | 0 | 5 | 6.4 | FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
CHEMBL4466483 | 178464 | 0 | None | -229 | 27 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 411 | 3 | 0 | 5 | 6.4 | FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
44327952 | 214823 | 0 | None | 1 | 5 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 367 | 5 | 3 | 3 | 2.6 | CC[C@@](C)(CO)CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 | 10.1021/jm030030n | |||
CHEMBL97518 | 214823 | 0 | None | 1 | 5 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 367 | 5 | 3 | 3 | 2.6 | CC[C@@](C)(CO)CNC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 | 10.1021/jm030030n | |||
3233 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm991151j | |||
3247 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm991151j | |||
6604889 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm991151j | |||
CHEMBL282199 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm991151j | |||
DB13988 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm991151j | |||
22857296 | 35923 | 0 | None | -123 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 389 | 4 | 2 | 3 | 4.1 | CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 | 10.1021/jm030030n | |||
CHEMBL13816 | 35923 | 0 | None | -123 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 389 | 4 | 2 | 3 | 4.1 | CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 | 10.1021/jm030030n | |||
44397433 | 19037 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 491 | 12 | 1 | 3 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1184710 | 19037 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 491 | 12 | 1 | 3 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL365084 | 19037 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 491 | 12 | 1 | 3 | 5.9 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
2470 | 10425 | 50 | None | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm030030n | |||
3300 | 10425 | 50 | None | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm030030n | |||
5265 | 10425 | 50 | None | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm030030n | |||
99 | 10425 | 50 | None | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm030030n | |||
CHEMBL267930 | 10425 | 50 | None | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm030030n | |||
44397429 | 18530 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 491 | 12 | 1 | 4 | 5.7 | COCCNCc1ccc(-c2ccc(CN(Cc3cccnc3)C(=O)/C=C/c3ccccc3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181634 | 18530 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 491 | 12 | 1 | 4 | 5.7 | COCCNCc1ccc(-c2ccc(CN(Cc3cccnc3)C(=O)/C=C/c3ccccc3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL186450 | 18530 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 491 | 12 | 1 | 4 | 5.7 | COCCNCc1ccc(-c2ccc(CN(Cc3cccnc3)C(=O)/C=C/c3ccccc3)cc2)cc1 | 10.1016/j.bmcl.2005.06.024 | |||
44456253 | 19609 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cc(F)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188517 | 19609 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cc(F)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536562 | 19609 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2cc(F)ccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
3233 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm030030n | |||
3247 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm030030n | |||
6604889 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm030030n | |||
CHEMBL282199 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm030030n | |||
DB13988 | 10285 | 44 | None | -10 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 352 | 5 | 1 | 4 | 2.7 | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O | 10.1021/jm030030n | |||
44350898 | 24752 | 0 | None | -1 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 370 | 5 | 0 | 3 | 5.2 | Cn1c2c(c3ccccc31)CN(CCCOc1cccc3ccccc13)CC2 | 10.1021/jm030080s | |||
CHEMBL126188 | 24752 | 0 | None | -1 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 370 | 5 | 0 | 3 | 5.2 | Cn1c2c(c3ccccc31)CN(CCCOc1cccc3ccccc13)CC2 | 10.1021/jm030080s | |||
44350897 | 124851 | 0 | None | -2 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 370 | 5 | 0 | 3 | 5.2 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc3ccccc3c1)CC2 | 10.1021/jm030080s | |||
CHEMBL340511 | 124851 | 0 | None | -2 | 2 | Mouse | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 370 | 5 | 0 | 3 | 5.2 | Cn1c2c(c3ccccc31)CN(CCCOc1ccc3ccccc3c1)CC2 | 10.1021/jm030080s | |||
12628906 | 101371 | 28 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 147 | 0 | 2 | 3 | 0.7 | NC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL25212 | 101371 | 28 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 147 | 0 | 2 | 3 | 0.7 | NC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL557381 | 101371 | 28 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 147 | 0 | 2 | 3 | 0.7 | NC1=Nc2ccccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
135508617 136016503 | 17402 | 0 | None | -12 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3ccc(Br)cc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL1170237 | 17402 | 0 | None | -12 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3ccc(Br)cc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
145977799 | 170422 | 0 | None | -9 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 257 | 3 | 1 | 3 | 2.9 | C[C@@H]1SC(c2ccccc2)=N[C@@H]1Cc1c[nH]cn1 | 10.1021/acs.jnatprod.7b00317 | |||
CHEMBL4204036 | 170422 | 0 | None | -9 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 257 | 3 | 1 | 3 | 2.9 | C[C@@H]1SC(c2ccccc2)=N[C@@H]1Cc1c[nH]cn1 | 10.1021/acs.jnatprod.7b00317 | |||
44582675 | 196480 | 0 | None | -114 | 15 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
CHEMBL515472 | 196480 | 0 | None | -114 | 15 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
117209965 | 192026 | 1 | None | -29 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 262 | 2 | 2 | 3 | 2.1 | Clc1ccc(-c2n[nH]cc2N2CCNCC2)cc1 | 10.1021/acs.jmedchem.1c01093 | |||
CHEMBL4858338 | 192026 | 1 | None | -29 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 262 | 2 | 2 | 3 | 2.1 | Clc1ccc(-c2n[nH]cc2N2CCNCC2)cc1 | 10.1021/acs.jmedchem.1c01093 | |||
4376990 | 199788 | 5 | None | -27 | 11 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 372 | 4 | 2 | 4 | 4.1 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(Cl)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5207529 | 199788 | 5 | None | -27 | 11 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 372 | 4 | 2 | 4 | 4.1 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(Cl)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
CHEMBL5222754 | 199788 | 5 | None | -27 | 11 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 372 | 4 | 2 | 4 | 4.1 | COc1cc(OC)c(C2NCCc3c2[nH]c2ccc(Cl)cc32)cc1OC | 10.1021/acsmedchemlett.1c00694 | |||
136118661 | 83032 | 0 | None | -7 | 5 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058429 | 83032 | 0 | None | -7 | 5 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3c(Br)cccc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
50923583 | 131935 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 356 | 3 | 2 | 3 | 2.6 | COc1cccc(F)c1-c1ncc(F)c2ccc(C(=O)N=C(N)N)cc12 | nan | |||
CHEMBL3644532 | 131935 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 356 | 3 | 2 | 3 | 2.6 | COc1cccc(F)c1-c1ncc(F)c2ccc(C(=O)N=C(N)N)cc12 | nan | |||
CHEMBL5094234 | 222352 | 0 | None | -331 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | CCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5096019 | 222352 | 0 | None | -331 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | CCNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5091270 | 222080 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | O=S1(=O)CCC[C@@H](CNCc2cccc3cccnc23)C1 | 10.1021/acs.jmedchem.1c02031 | |||||
44355201 | 121996 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 247 | 7 | 0 | 2 | 3.7 | CCCN(CCC)[C@@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL334553 | 121996 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 247 | 7 | 0 | 2 | 3.7 | CCCN(CCC)[C@@H]1C[C@@H]1c1cccc(OC)c1 | 10.1016/0960-894X(96)00045-5 | |||
130442572 | 178687 | 0 | None | -158 | 24 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 395 | 3 | 0 | 5 | 6.0 | FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
CHEMBL4469848 | 178687 | 0 | None | -158 | 24 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 395 | 3 | 0 | 5 | 6.0 | FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
21509921 | 111235 | 0 | None | -74 | 24 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
CHEMBL3104091 | 111235 | 0 | None | -74 | 24 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
44351047 | 24854 | 0 | None | - | 1 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 324 | 5 | 1 | 2 | 4.1 | Fc1ccc(OCCCN2CCc3[nH]c4ccccc4c3C2)cc1 | 10.1021/jm030080s | |||
CHEMBL126724 | 24854 | 0 | None | - | 1 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 324 | 5 | 1 | 2 | 4.1 | Fc1ccc(OCCCN2CCc3[nH]c4ccccc4c3C2)cc1 | 10.1021/jm030080s | |||
44351139 | 25616 | 0 | None | 1 | 3 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.5 | CCn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
CHEMBL128099 | 25616 | 0 | None | 1 | 3 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.5 | CCn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 | 10.1021/jm030080s | |||
21509921 | 111235 | 0 | None | -74 | 24 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
CHEMBL3104091 | 111235 | 0 | None | -74 | 24 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
73355415 | 99308 | 0 | None | -38 | 13 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 277 | 3 | 1 | 1 | 2.1 | C1C2C3CC4C2C2C1C3[C@H](NCC13C5C6C7C5C1C7C63)C42 | 10.1016/j.bmc.2013.07.045 | |||
CHEMBL2432039 | 99308 | 0 | None | -38 | 13 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 277 | 3 | 1 | 1 | 2.1 | C1C2C3CC4C2C2C1C3[C@H](NCC13C5C6C7C5C1C7C63)C42 | 10.1016/j.bmc.2013.07.045 | |||
44355164 | 29813 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL133020 | 29813 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 247 | 7 | 1 | 2 | 3.6 | CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00045-5 | |||
2737389 | 194365 | 28 | None | -53 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 238 | 2 | 1 | 2 | 2.8 | c1ccc(-c2ccccc2N2CCNCC2)cc1 | 10.1039/C8MD00313K | |||
CHEMBL494675 | 194365 | 28 | None | -53 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 238 | 2 | 1 | 2 | 2.8 | c1ccc(-c2ccccc2N2CCNCC2)cc1 | 10.1039/C8MD00313K | |||
71459604 | 90568 | 0 | None | -13 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1cccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)c1 | 10.1016/j.bmcl.2012.08.046 | |||
CHEMBL2205811 | 90568 | 0 | None | -13 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1cccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)c1 | 10.1016/j.bmcl.2012.08.046 | |||
136118620 | 83027 | 0 | None | -24 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3cccc(Br)c23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058419 | 83027 | 0 | None | -24 | 5 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3cccc(Br)c23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
44397669 | 18559 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 531 | 13 | 1 | 3 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)C1CC1c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1181776 | 18559 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 531 | 13 | 1 | 3 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)C1CC1c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL191583 | 18559 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 531 | 13 | 1 | 3 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCc3ccccc3)cc2)cc1)C(=O)C1CC1c1ccccc1 | 10.1016/j.bmcl.2005.06.024 | |||
44397362 | 19031 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 527 | 15 | 1 | 4 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCOc3ccccc3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL1184673 | 19031 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 527 | 15 | 1 | 4 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCOc3ccccc3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
CHEMBL363678 | 19031 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 527 | 15 | 1 | 4 | 6.4 | CN(C)CCN(Cc1ccc(-c2ccc(CNCCOc3ccccc3)cc2)cc1)C(=O)CCC1CCCC1 | 10.1016/j.bmcl.2005.06.024 | |||
44455983 | 104371 | 1 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 189 | 2 | 2 | 3 | 2.1 | CCCC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270840 | 104371 | 1 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 189 | 2 | 2 | 3 | 2.1 | CCCC1NC(N)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.080 | |||
44456400 | 19606 | 0 | None | -2 | 10 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188501 | 19606 | 0 | None | -2 | 10 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL2436555 | 19606 | 0 | None | -2 | 10 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536539 | 19606 | 0 | None | -2 | 10 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2ccc(Cl)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 10.1016/j.ejmech.2013.01.044 | |||
145967795 | 171602 | 0 | None | -5 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 213 | 2 | 1 | 4 | 2.0 | C[C@@H]1SC(c2ccsc2)=N[C@H]1CO | 10.1021/acs.jnatprod.7b00317 | |||
CHEMBL4218679 | 171602 | 0 | None | -5 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 213 | 2 | 1 | 4 | 2.0 | C[C@@H]1SC(c2ccsc2)=N[C@H]1CO | 10.1021/acs.jnatprod.7b00317 | |||
44455973 | 104244 | 7 | None | 1 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 209 | 1 | 2 | 3 | 2.3 | CCC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL270176 | 104244 | 7 | None | 1 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 209 | 1 | 2 | 3 | 2.3 | CCC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
160510 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1016/j.bmcl.2003.09.027 | |||
CHEMBL1506260 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1016/j.bmcl.2003.09.027 | |||
CHEMBL295234 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1016/j.bmcl.2003.09.027 | |||
160510 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1021/acs.jmedchem.0c01887 | |||
CHEMBL1506260 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1021/acs.jmedchem.0c01887 | |||
CHEMBL295234 | 107904 | 40 | None | -3 | 6 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 184 | 0 | 1 | 1 | 2.5 | CC1=NCCc2c1[nH]c1ccccc21 | 10.1021/acs.jmedchem.0c01887 | |||
49783209 | 24381 | 0 | None | -14791 | 26 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 396 | 7 | 1 | 6 | 3.8 | CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1 | 10.1021/jm100668r | |||
CHEMBL1258223 | 24381 | 0 | None | -14791 | 26 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 396 | 7 | 1 | 6 | 3.8 | CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1 | 10.1021/jm100668r | |||
155551348 | 180736 | 0 | None | -1 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 3.7 | CCOC(=O)[C@@]12C[C@@H]1[C@@H](n1cnc3c(NC(C4CC4)C4CC4)nc(Cl)nc31)[C@@H]1OC(C)(C)O[C@@H]12 | 10.1021/acs.jmedchem.8b01662 | |||
CHEMBL4541409 | 180736 | 0 | None | -1 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 3.7 | CCOC(=O)[C@@]12C[C@@H]1[C@@H](n1cnc3c(NC(C4CC4)C4CC4)nc(Cl)nc31)[C@@H]1OC(C)(C)O[C@@H]12 | 10.1021/acs.jmedchem.8b01662 | |||
136152977 | 104661 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 225 | 2 | 2 | 3 | 2.2 | CC1NC(NCC(F)F)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL272355 | 104661 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 225 | 2 | 2 | 3 | 2.2 | CC1NC(NCC(F)F)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
1355 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
142 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
CHEMBL478 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
DB12110 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
1355 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
142 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
CHEMBL478 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
DB12110 | 8792 | 88 | None | -549 | 16 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 196 | 1 | 1 | 2 | 1.8 | Clc1cccc(c1)N1CCNCC1 | 10.1021/jm030030n | |||
44351103 | 27081 | 0 | None | -9 | 2 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 396 | 7 | 0 | 3 | 5.5 | c1ccc(Cn2c3c(c4ccccc42)CN(CCCOc2ccccc2)CC3)cc1 | 10.1021/jm030080s | |||
CHEMBL130586 | 27081 | 0 | None | -9 | 2 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 396 | 7 | 0 | 3 | 5.5 | c1ccc(Cn2c3c(c4ccccc42)CN(CCCOc2ccccc2)CC3)cc1 | 10.1021/jm030080s | |||
132060720 | 169268 | 0 | None | -2 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 315 | 4 | 0 | 2 | 4.9 | COc1cccc(-c2ccc3c(c2)CN(Cc2ccccc2)C3)c1 | 10.1016/j.ejmech.2018.02.024 | |||
CHEMBL4167315 | 169268 | 0 | None | -2 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 315 | 4 | 0 | 2 | 4.9 | COc1cccc(-c2ccc3c(c2)CN(Cc2ccccc2)C3)c1 | 10.1016/j.ejmech.2018.02.024 | |||
44456398 | 20722 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1196644 | 20722 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL557746 | 20722 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 161 | 0 | 2 | 3 | 1.0 | Cc1ccc2c(c1)CNC(N)=N2 | 10.1016/j.bmcl.2007.10.080 | |||
135464118 | 99835 | 0 | None | -2 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3ccc(Br)cc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2442272 | 99835 | 0 | None | -2 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 304 | 1 | 4 | 2 | 1.9 | N=C1NC(=O)/C(=C\c2c[nH]c3ccc(Br)cc23)N1 | 10.1016/j.bmc.2013.09.011 | |||
44456244 | 104761 | 1 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2c(Cl)cccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL272752 | 104761 | 1 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2c(Cl)cccc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
53325242 | 63844 | 0 | None | -4 | 17 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 537 | 8 | 1 | 2 | 7.9 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
CHEMBL1644978 | 63844 | 0 | None | -4 | 17 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 537 | 8 | 1 | 2 | 7.9 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
1621 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
17 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
5761 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
CHEMBL263881 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
DB04829 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
10405482 | 25914 | 0 | None | 11 | 2 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 348 | 6 | 0 | 3 | 4.6 | COc1ccc(CCCCN2CCc3c(c4ccccc4n3C)C2)cc1 | 10.1021/jm030080s | |||
CHEMBL128945 | 25914 | 0 | None | 11 | 2 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 348 | 6 | 0 | 3 | 4.6 | COc1ccc(CCCCN2CCc3c(c4ccccc4n3C)C2)cc1 | 10.1021/jm030080s | |||
CHEMBL5091373 | 222346 | 0 | None | -436 | 9 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
CHEMBL5095981 | 222346 | 0 | None | -436 | 9 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CNCCc1ccc(Cl)c(-c2ccccc2OC)c1 | 10.1021/acs.jmedchem.1c00110 | |||||
44456286 | 19618 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2ccc(F)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1188596 | 19618 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2ccc(F)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL536790 | 19618 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 165 | 0 | 2 | 3 | 0.9 | NC1=Nc2ccc(F)cc2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
136118659 | 83030 | 0 | None | -5 | 5 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3ccc(Br)cc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL2058427 | 83030 | 0 | None | -5 | 5 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 346 | 1 | 1 | 2 | 2.7 | C/N=C1\N(C)C(=O)/C(=C\c2c[nH]c3ccc(Br)cc23)N1C | 10.1016/j.bmc.2013.09.011 | |||
10881882 | 24964 | 0 | None | -3 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 324 | 4 | 0 | 3 | 3.8 | Cn1c2c(c3ccccc31)CN(CCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL126994 | 24964 | 0 | None | -3 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 324 | 4 | 0 | 3 | 3.8 | Cn1c2c(c3ccccc31)CN(CCOc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
122483292 | 144889 | 0 | None | -33 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 5.5 | O=C(CCCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3764335 | 144889 | 0 | None | -33 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 5.5 | O=C(CCCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
CHEMBL3765876 | 144889 | 0 | None | -33 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 5.5 | O=C(CCCCCN1CCN(c2ccccc2O)CC1)n1c2ccccc2c2ccccc21 | 10.1016/j.ejmech.2016.01.043 | |||
44351499 | 125331 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 336 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(CCCCc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
CHEMBL341506 | 125331 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 336 | 5 | 0 | 2 | 4.7 | Cn1c2c(c3ccccc31)CN(CCCCc1ccc(F)cc1)CC2 | 10.1021/jm030080s | |||
130442480 | 182049 | 0 | None | -117 | 24 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 410 | 3 | 0 | 6 | 5.7 | Cc1ncc2nccn2c1-c1ccc(Oc2nccc3occc23)cc1C(F)(F)F | 10.1021/acs.jmedchem.9b00351 | |||
CHEMBL4572614 | 182049 | 0 | None | -117 | 24 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 410 | 3 | 0 | 6 | 5.7 | Cc1ncc2nccn2c1-c1ccc(Oc2nccc3occc23)cc1C(F)(F)F | 10.1021/acs.jmedchem.9b00351 | |||
136152967 | 162344 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 261 | 2 | 2 | 5 | 1.3 | CC1NC(NCC2COCCO2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
CHEMBL404365 | 162344 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 261 | 2 | 2 | 5 | 1.3 | CC1NC(NCC2COCCO2)=Nc2ccccc21 | 10.1016/j.bmcl.2007.10.078 | |||
135433933 | 183817 | 1 | None | -8 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3cc(Br)ccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
CHEMBL463249 | 183817 | 1 | None | -8 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 332 | 1 | 2 | 2 | 2.6 | CN1C(=N)N(C)/C(=C/c2c[nH]c3cc(Br)ccc23)C1=O | 10.1016/j.bmc.2013.09.011 | |||
44456207 | 20418 | 7 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL1194499 | 20418 | 7 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL552782 | 20418 | 7 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 177 | 1 | 2 | 4 | 0.7 | COc1cccc2c1N=C(N)NC2 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL5077293 | 221270 | 0 | None | -346 | 9 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | COc1ccccc1-c1cc(C2CCNC2)ccc1Cl | 10.1021/acs.jmedchem.1c00110 | |||||
44351184 | 25633 | 0 | None | 1 | 3 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)c1c(n2C)CCN(CCCOc2ccc(F)cc2)C1 | 10.1021/jm030080s | |||
CHEMBL128185 | 25633 | 0 | None | 1 | 3 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 368 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)c1c(n2C)CCN(CCCOc2ccc(F)cc2)C1 | 10.1021/jm030080s | |||
23642275 | 7270 | 31 | None | -60 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 283 | 2 | 0 | 3 | 3.1 | CN([C@H]1CCc2c(C1)cccc2c1c(C)nn(c1C)C)C | 10.1039/C8MD00313K | |||
8433 | 7270 | 31 | None | -60 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 283 | 2 | 0 | 3 | 3.1 | CN([C@H]1CCc2c(C1)cccc2c1c(C)nn(c1C)C)C | 10.1039/C8MD00313K | |||
CHEMBL2164327 | 7270 | 31 | None | -60 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 283 | 2 | 0 | 3 | 3.1 | CN([C@H]1CCc2c(C1)cccc2c1c(C)nn(c1C)C)C | 10.1039/C8MD00313K | |||
13702393 | 161804 | 2 | None | 6 | 6 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cccc(Cl)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL401541 | 161804 | 2 | None | 6 | 6 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cccc(Cl)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
CHEMBL556983 | 161804 | 2 | None | 6 | 6 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 181 | 0 | 2 | 3 | 1.4 | NC1=Nc2cccc(Cl)c2CN1 | 10.1016/j.bmcl.2007.10.080 | |||
118464427 | 145112 | 0 | None | -36 | 7 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 328 | 3 | 4 | 6 | 1.8 | CCNC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
CHEMBL3771331 | 145112 | 0 | None | -36 | 7 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 328 | 3 | 4 | 6 | 1.8 | CCNC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 | 10.1021/acs.jmedchem.5b01631 | |||
44355200 | 33110 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
CHEMBL135894 | 33110 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6 | Binding | ChEMBL | 261 | 8 | 0 | 2 | 3.9 | CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1OC | 10.1016/0960-894X(96)00045-5 | |||
2543 | 10479 | 68 | None | -1412 | 32 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
5358 | 10479 | 68 | None | -1412 | 32 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
54 | 10479 | 68 | None | -1412 | 32 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL128 | 10479 | 68 | None | -1412 | 32 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB00669 | 10479 | 68 | None | -1412 | 32 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
4106 | 9280 | 22 | 3H-5CT | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
5358812 | 9280 | 22 | 3H-5CT | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
89 | 9280 | 22 | 3H-5CT | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
CHEMBL93240 | 9280 | 22 | 3H-5CT | -14 | 33 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
4106 | 9280 | 22 | 125I-LSD | -269 | 33 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
5358812 | 9280 | 22 | 125I-LSD | -269 | 33 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
89 | 9280 | 22 | 125I-LSD | -269 | 33 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
CHEMBL93240 | 9280 | 22 | 125I-LSD | -269 | 33 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
1220 | 6975 | 55 | 125I-LSD | -794 | 44 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
31 | 6975 | 55 | 125I-LSD | -794 | 44 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
7 | 6975 | 55 | 125I-LSD | -794 | 44 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
CHEMBL56 | 6975 | 55 | 125I-LSD | -794 | 44 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
10257 | 7525 | 31 | 125I-LSD | -741 | 19 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
144 | 7525 | 31 | 125I-LSD | -741 | 19 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
CHEMBL416526 | 7525 | 31 | 125I-LSD | -741 | 19 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
DB01445 | 7525 | 31 | 125I-LSD | -741 | 19 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
135398737 | 7745 | 93 | 3H-5CT | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
38 | 7745 | 93 | 3H-5CT | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
722 | 7745 | 93 | 3H-5CT | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
CHEMBL42 | 7745 | 93 | 3H-5CT | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
DB00363 | 7745 | 93 | 3H-5CT | -173 | 90 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
11957541 | 8241 | 40 | 125I-LSD | -229 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 2.2 | COc1cc(I)c(cc1CC(N)C)OC | None | |||
1229 | 8241 | 40 | 125I-LSD | -229 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 2.2 | COc1cc(I)c(cc1CC(N)C)OC | None | |||
147 | 8241 | 40 | 125I-LSD | -229 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 2.2 | COc1cc(I)c(cc1CC(N)C)OC | None | |||
170617 | 8241 | 40 | 125I-LSD | -229 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 2.2 | COc1cc(I)c(cc1CC(N)C)OC | None | |||
CHEMBL6616 | 8241 | 40 | 125I-LSD | -229 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 2.2 | COc1cc(I)c(cc1CC(N)C)OC | None | |||
681 | 8247 | 72 | 125I-LSD | -199 | 38 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
940 | 8247 | 72 | 125I-LSD | -199 | 38 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
947 | 8247 | 72 | 125I-LSD | -199 | 38 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
CHEMBL59 | 8247 | 72 | 125I-LSD | -199 | 38 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
DB00988 | 8247 | 72 | 125I-LSD | -199 | 38 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
1357 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
1672 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
224 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
896 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
CHEMBL45 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
DB01065 | 9263 | 139 | 125I-LSD | -3311 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 232 | 4 | 2 | 2 | 1.9 | COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2 | None | |||
206 | 9271 | 16 | 125I-LSD | -676 | 25 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 362 | 3 | 1 | 4 | 1.3 | CN1C[C@H](C[C@H]2[C@H]1Cc1cn(c3c1c2ccc3)C)NS(=O)(=O)N(C)C | None | |||
68848 | 9271 | 16 | 125I-LSD | -676 | 25 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 362 | 3 | 1 | 4 | 1.3 | CN1C[C@H](C[C@H]2[C@H]1Cc1cn(c3c1c2ccc3)C)NS(=O)(=O)N(C)C | None | |||
CHEMBL12314 | 9271 | 16 | 125I-LSD | -676 | 25 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 362 | 3 | 1 | 4 | 1.3 | CN1C[C@H](C[C@H]2[C@H]1Cc1cn(c3c1c2ccc3)C)NS(=O)(=O)N(C)C | None | |||
133 | 9274 | 52 | 125I-LSD | -1862 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
1723 | 9274 | 52 | 125I-LSD | -1862 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
28693 | 9274 | 52 | 125I-LSD | -1862 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
CHEMBL19215 | 9274 | 52 | 125I-LSD | -1862 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
DB13520 | 9274 | 52 | 125I-LSD | -1862 | 43 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
134 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
484 | 9633 | 51 | 125I-LSD | -31 | 35 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
951 | 9633 | 51 | 125I-LSD | -31 | 35 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
CHEMBL432 | 9633 | 51 | 125I-LSD | -31 | 35 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
1243 | 10390 | 34 | 125I-LSD | -3235 | 5 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 1 | 1 | 2 | 3.8 | CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O | None | |||
944 | 10390 | 34 | 125I-LSD | -3235 | 5 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 1 | 1 | 2 | 3.8 | CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O | None | |||
CHEMBL324017 | 10390 | 34 | 125I-LSD | -3235 | 5 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 1 | 1 | 2 | 3.8 | CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Br)O | None | |||
102 | 10899 | 48 | 125I-LSD | -1698 | 49 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
102 | 10899 | 48 | 125I-LSD | -2511 | 49 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | 125I-LSD | -1698 | 49 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | 125I-LSD | -2511 | 49 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | 125I-LSD | -1698 | 49 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | 125I-LSD | -2511 | 49 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | 125I-LSD | -1698 | 49 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | 125I-LSD | -2511 | 49 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | 125I-LSD | -1698 | 49 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | 125I-LSD | -2511 | 49 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
108182 | 10903 | 22 | 125I-LSD | -3 | 17 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | None | |||
245 | 10903 | 22 | 125I-LSD | -3 | 17 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | None | |||
CHEMBL18041 | 10903 | 22 | 125I-LSD | -3 | 17 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 309 | 3 | 2 | 4 | 1.8 | COc1cc(N)c(cc1C(=O)NC1CN2CCC1CC2)Cl | None | |||
None | 223158 | 0 | UNDEFINED | -1122 | 11 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 243 | 3 | 1 | 4 | 2.7 | CCC1=CC2=C(O1)C=CC3=C2N(N=C3)CC(C)N | None | |||
179 | 7188 | 115 | 3H-LSD | -4365 | 50 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
2159 | 7188 | 115 | 3H-LSD | -4365 | 50 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
963 | 7188 | 115 | 3H-LSD | -4365 | 50 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
CHEMBL243712 | 7188 | 115 | 3H-LSD | -4365 | 50 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
DB06288 | 7188 | 115 | 3H-LSD | -4365 | 50 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
681 | 8247 | 72 | 125I-LSD | -1995 | 38 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
940 | 8247 | 72 | 125I-LSD | -1995 | 38 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
947 | 8247 | 72 | 125I-LSD | -1995 | 38 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
CHEMBL59 | 8247 | 72 | 125I-LSD | -1995 | 38 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
DB00988 | 8247 | 72 | 125I-LSD | -1995 | 38 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
1524 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
197 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
3822 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
88 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
CHEMBL51 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
DB12465 | 8962 | 96 | 125I-LSD | -7585 | 51 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
134 | 9292 | 24 | 3H-LSD | -162 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | 3H-LSD | -162 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | 3H-LSD | -162 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | 3H-LSD | -162 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | 3H-LSD | -162 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
484 | 9633 | 51 | 125I-LSD | -100 | 35 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
484 | 9633 | 51 | 3H-KETANSERIN | -31 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
951 | 9633 | 51 | 125I-LSD | -100 | 35 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
951 | 9633 | 51 | 3H-KETANSERIN | -31 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
CHEMBL432 | 9633 | 51 | 125I-LSD | -100 | 35 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
CHEMBL432 | 9633 | 51 | 3H-KETANSERIN | -31 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 2 | 4 | 4 | 0.1 | NCC(c1ccc(c(c1)O)O)O | None | |||
15897 | 9637 | 0 | 3H-LSD | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
215 | 9637 | 0 | 3H-LSD | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
CHEMBL1979333 | 9637 | 0 | 3H-LSD | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
119570 | 9933 | 96 | 3H-LSD | -4570 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
2233 | 9933 | 96 | 3H-LSD | -4570 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
953 | 9933 | 96 | 3H-LSD | -4570 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
CHEMBL301265 | 9933 | 96 | 3H-LSD | -4570 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
DB00413 | 9933 | 96 | 3H-LSD | -4570 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
243 | 9976 | 91 | 3H-5CT | -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-5CT | -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-5CT | -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-5CT | -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-5CT | -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 | |||
173 | 10036 | 95 | 3H-LSD | -114 | 23 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 213 | 1 | 1 | 3 | 1.6 | N1CCN(CC1)c1ccc2c(n1)cccc2 | None | |||
5011 | 10036 | 95 | 3H-LSD | -114 | 23 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 213 | 1 | 1 | 3 | 1.6 | N1CCN(CC1)c1ccc2c(n1)cccc2 | None | |||
CHEMBL18772 | 10036 | 95 | 3H-LSD | -114 | 23 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 213 | 1 | 1 | 3 | 1.6 | N1CCN(CC1)c1ccc2c(n1)cccc2 | None | |||
2402 | 10143 | 62 | 3H-LSD | -549 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
5095 | 10143 | 62 | 3H-LSD | -549 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
7295 | 10143 | 62 | 3H-LSD | -549 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
CHEMBL589 | 10143 | 62 | 3H-LSD | -549 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
DB00268 | 10143 | 62 | 3H-LSD | -549 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
128563 | 10237 | 33 | 3H-LSD | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
1666 | 10237 | 33 | 3H-LSD | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
CHEMBL445332 | 10237 | 33 | 3H-LSD | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
DB12327 | 10237 | 33 | 3H-LSD | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
2543 | 10479 | 68 | 125I-LSD | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
2543 | 10479 | 68 | UNDEFINED | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
5358 | 10479 | 68 | 125I-LSD | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
5358 | 10479 | 68 | UNDEFINED | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
54 | 10479 | 68 | 125I-LSD | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
54 | 10479 | 68 | UNDEFINED | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL128 | 10479 | 68 | 125I-LSD | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL128 | 10479 | 68 | UNDEFINED | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB00669 | 10479 | 68 | 125I-LSD | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB00669 | 10479 | 68 | UNDEFINED | -257 | 32 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
185 | 10778 | 60 | 3H-LSD | -30902 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
5311271 | 10778 | 60 | 3H-LSD | -30902 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
CHEMBL74355 | 10778 | 60 | 3H-LSD | -30902 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
DB16351 | 10778 | 60 | 3H-LSD | -30902 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
102 | 10899 | 48 | 3H-LSD | -1698 | 49 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | 3H-LSD | -1698 | 49 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | 3H-LSD | -1698 | 49 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | 3H-LSD | -1698 | 49 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | 3H-LSD | -1698 | 49 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
2662 | 18156 | 131 | 3H-Alpha-Me-histamine | -41 | 30 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 381 | 3 | 1 | 4 | 3.5 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 | None | |||
CHEMBL118 | 18156 | 131 | 3H-Alpha-Me-histamine | -41 | 30 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 381 | 3 | 1 | 4 | 3.5 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 | None | |||
5090 | 22333 | 106 | 3H-Alpha-Me-histamine | -1348 | 30 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 0 | 4 | 2.6 | CS(=O)(=O)c1ccc(C2=C(c3ccccc3)C(=O)OC2)cc1 | None | |||
CHEMBL122 | 22333 | 106 | 3H-Alpha-Me-histamine | -1348 | 30 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 0 | 4 | 2.6 | CS(=O)(=O)c1ccc(C2=C(c3ccccc3)C(=O)OC2)cc1 | None | |||
10297 | 33885 | 30 | 3H-LSD | -38 | 43 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | C[C@H](N)[C@H](O)c1ccccc1 | None | |||
CHEMBL136560 | 33885 | 30 | 3H-LSD | -38 | 43 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | C[C@H](N)[C@H](O)c1ccccc1 | None | |||
156391 | 53574 | 99 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | None | |||
CHEMBL1200806 | 53574 | 99 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | None | |||
CHEMBL154 | 53574 | 99 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | 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 | |||
2244 | 101008 | 100 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 180 | 2 | 1 | 3 | 1.3 | CC(=O)Oc1ccccc1C(=O)O | None | |||
CHEMBL25 | 101008 | 100 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 180 | 2 | 1 | 3 | 1.3 | CC(=O)Oc1ccccc1C(=O)O | None | |||
3663 | 106743 | 83 | 3H-LSD | -288 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | None | |||
CHEMBL286494 | 106743 | 83 | 3H-LSD | -288 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | None | |||
446220 | 140299 | 14 | 3H-LSD | -1778 | 45 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
CHEMBL370805 | 140299 | 14 | 3H-LSD | -1778 | 45 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
1615 | 174570 | 24 | 3H-LSD | -26 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 193 | 3 | 1 | 3 | 1.6 | CNC(C)Cc1ccc2c(c1)OCO2 | None | |||
CHEMBL43048 | 174570 | 24 | 3H-LSD | -26 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 193 | 3 | 1 | 3 | 1.6 | CNC(C)Cc1ccc2c(c1)OCO2 | None | |||
5280343 | 195054 | 124 | 3H-LSD | -147 | 31 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
CHEMBL1520590 | 195054 | 124 | 3H-LSD | -147 | 31 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
CHEMBL50 | 195054 | 124 | 3H-LSD | -147 | 31 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
54676228 | 200394 | 112 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 331 | 2 | 2 | 5 | 1.6 | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | None | |||
CHEMBL527 | 200394 | 112 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 331 | 2 | 2 | 5 | 1.6 | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | None | |||
4495 | 203314 | 92 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | None | |||
CHEMBL56367 | 203314 | 92 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | None | |||
54677470 | 207330 | 115 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
CHEMBL1256873 | 207330 | 115 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
CHEMBL599 | 207330 | 115 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
162265 | 209053 | 22 | 3H-LSD | -239 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
4786 | 209053 | 22 | 3H-LSD | -239 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
CHEMBL61006 | 209053 | 22 | 3H-LSD | -239 | 44 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
5281600 | 209804 | 92 | 3H-LSD | -275 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 538 | 3 | 6 | 10 | 5.1 | O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12 | None | |||
CHEMBL63354 | 209804 | 92 | 3H-LSD | -275 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 538 | 3 | 6 | 10 | 5.1 | O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12 | None | |||
1973 | 210262 | 15 | 3H-LSD | -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 | 3H-LSD | -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 | 3H-LSD | -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 | |||
202478 | 211466 | 20 | 3H-LSD | -52 | 25 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 219 | 3 | 1 | 2 | 3.0 | CCCN1CCC[C@H](c2cccc(O)c2)C1 | None | |||
CHEMBL7393 | 211466 | 20 | 3H-LSD | -52 | 25 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 219 | 3 | 1 | 2 | 3.0 | CCCN1CCC[C@H](c2cccc(O)c2)C1 | None | |||
3821 | 211497 | 17 | 3H-LSD | -1 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 237 | 2 | 1 | 2 | 2.9 | CNC1(c2ccccc2Cl)CCCCC1=O | None | |||
CHEMBL742 | 211497 | 17 | 3H-LSD | -1 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 237 | 2 | 1 | 2 | 2.9 | CNC1(c2ccccc2Cl)CCCCC1=O | None | |||
5311189 | 211620 | 11 | 3H-LSD | -112 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 219 | 3 | 1 | 2 | 3.0 | CCCN1CCC[C@@H](c2cccc(O)c2)C1 | None | |||
CHEMBL7549 | 211620 | 11 | 3H-LSD | -112 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 219 | 3 | 1 | 2 | 3.0 | CCCN1CCC[C@@H](c2cccc(O)c2)C1 | None | |||
4158 | 212120 | 21 | 3H-LSD | -141 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 233 | 3 | 1 | 3 | 2.1 | COC(=O)C(c1ccccc1)C1CCCCN1 | None | |||
CHEMBL1722 | 212120 | 21 | 3H-LSD | -141 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 233 | 3 | 1 | 3 | 2.1 | COC(=O)C(c1ccccc1)C1CCCCN1 | None | |||
CHEMBL796 | 212120 | 21 | 3H-LSD | -141 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 233 | 3 | 1 | 3 | 2.1 | COC(=O)C(c1ccccc1)C1CCCCN1 | None | |||
119607 | 212982 | 113 | 3H-Alpha-Me-histamine | -97 | 27 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 1 | 4 | 3.0 | Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 | None | |||
CHEMBL865 | 212982 | 113 | 3H-Alpha-Me-histamine | -97 | 27 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 1 | 4 | 3.0 | Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 | None | |||
3337 | 213146 | 27 | 3H-LSD | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
65801 | 213146 | 27 | 3H-LSD | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
66264 | 213146 | 27 | 3H-LSD | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
91452 | 213146 | 27 | 3H-LSD | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
CHEMBL87493 | 213146 | 27 | 3H-LSD | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
165193 | 222724 | 0 | 125I-LSD | -42657 | 30 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
62882 | 222724 | 0 | 125I-LSD | -42657 | 30 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
66366 | 222724 | 0 | 125I-LSD | -42657 | 30 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
None | 222772 | 0 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 2 | 0 | 4 | 3.6 | CC1=NC=CN1CC2CCC3=C(C2=O)C4=CC=CC=C4N3C.Cl | None | |||
25137849 | 222958 | 0 | 3H-LSD | -4 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 165 | 3 | 2 | 2 | 1.3 | CC(C(C1=CC=CC=C1)O)NC | None | |||
71290 | 222958 | 0 | 3H-LSD | -4 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 165 | 3 | 2 | 2 | 1.3 | CC(C(C1=CC=CC=C1)O)NC | None | |||
None | 223018 | 0 | 3H-LSD | -95499 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 316 | 7 | 3 | 3 | 3.0 | CC(CF)NCC(COC1=CC=CC2=C1C3=CC=CC=C3N2)O | None | |||
None | 223090 | 0 | 3H-LSD | -1 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 240 | 7 | 4 | 6 | -0.8 | C(C(C(=O)O)N)SSCC(C(=O)O)N | None | |||
None | 223091 | 0 | 3H-LSD | -1 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 149 | 4 | 2 | 3 | 0.2 | CSCCC(C(=O)O)N | None | |||
None | 223092 | 0 | 3H-LSD | -1 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 135 | 3 | 3 | 3 | -0.3 | C(CS)C(C(=O)O)N | None | |||
None | 223093 | 0 | 3H-LSD | -1 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 3 | 3 | -0.7 | C(C(C(=O)O)N)S | None | |||
None | 223094 | 0 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 117 | 0 | 1 | 3 | -0.0 | C1CSC(=O)C1N | None | |||
None | 223095 | 0 | 3H-LSD | -1 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 3 | 3 | 3 | -1.4 | C(C(C(=O)O)N)S(=O)O | None | |||
None | 223096 | 0 | 3H-LSD | -1 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 3 | 3 | 4 | -1.7 | C(C(C(=O)O)N)S(=O)(=O)O | None | |||
None | 223097 | 0 | 3H-LSD | -1 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 183 | 4 | 3 | 4 | -1.3 | C(CS(=O)(=O)O)C(C(=O)O)N | None | |||
None | 223104 | 0 | 3H-LSD | -13 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 149 | 2 | 1 | 2 | 1.2 | CC(C(=O)C1=CC=CC=C1)N | None | |||
1576 | 223105 | 0 | 3H-LSD | -16 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 163 | 3 | 1 | 2 | 1.5 | CC(C(=O)C1=CC=CC=C1)NC | None | |||
None | 223106 | 0 | 3H-LSD | -16 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 536 | 11 | 1 | 4 | 9.0 | CC(C)C(=O)C12C(=O)C(=C(C(C1=O)(CC(C2(C)CCC=C(C)C)CC=C(C)C)CC=C(C)C)O)CC=C(C)C | None | |||
4978 | 223107 | 0 | 3H-LSD | -7 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 520 | 1 | 7 | 9 | 4.3 | CC1=CC(=C2C3=C1C4=C5C(=C(C=C4CO)O)C(=O)C6=C(C=C(C7=C6C5=C3C8=C7C(=CC(=C8C2=O)O)O)O)O)O | None | |||
None | 223108 | 0 | 3H-LSD | -3 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 464 | 4 | 8 | 12 | -0.6 | C1=CC(=C(C=C1C2=C(C(=C3C(=CC(=O)C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | None | |||
None | 223109 | 0 | 3H-LSD | -281 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 610 | 6 | 10 | 16 | -1.7 | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O | None | |||
None | 223110 | 0 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 448 | 3 | 7 | 11 | 0.4 | CC1C(C(C(C(O1)OC2=C(OC3=CC(=O)C=C(C3=C2O)O)C4=CC(=C(C=C4)O)O)O)O)O | None | |||
135269 | 223168 | 0 | 3H-LSD | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 222 | 5 | 1 | 3 | 2.5 | CCCCC(=O)OC1=CC=CC=C1C(=O)O | None | |||
23681059 | 223169 | 0 | 3H-LSD | -1 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O | None | |||
5018304 | 223170 | 0 | 3H-LSD | -1 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 317 | 4 | 1 | 3 | 0.0 | C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[Na+] | None | |||
84003 | 223171 | 0 | 3H-LSD | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 376 | 6 | 5 | 7 | -0.0 | C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)O.C(C(CO)(CO)N)O | None | |||
123619 | 223172 | 0 | 3H-Alpha-Me-histamine | -1412 | 27 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 358 | 3 | 0 | 4 | 4.2 | CC1=NC=C(C=C1)C2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)Cl | None | |||
119828 | 223173 | 0 | 3H-Alpha-Me-histamine | -1 | 29 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 5 | 1 | 5 | 3.5 | CCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C | None | |||
None | 223174 | 0 | 3H-Alpha-Me-histamine | -7 | 28 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 517 | 8 | 2 | 5 | 5.2 | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCC4=CC=C(C=C4)NC(=O)C | None | |||
5 | 6927 | 72 | 3H-LSD | -891 | 53 | Mouse | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | 3H-LSD | -891 | 53 | Mouse | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | 3H-LSD | -891 | 53 | Mouse | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | 3H-LSD | -891 | 53 | Mouse | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
2726 | 7706 | 68 | 3H-LSD | -16 | 72 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
621 | 7706 | 68 | 3H-LSD | -16 | 72 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
83 | 7706 | 68 | 3H-LSD | -16 | 72 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
CHEMBL71 | 7706 | 68 | 3H-LSD | -16 | 72 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
DB00477 | 7706 | 68 | 3H-LSD | -16 | 72 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
1809 | 6922 | 32 | UNDEFINED | -257 | 37 | Mouse | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
1809 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | UNDEFINED | -257 | 37 | Mouse | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | UNDEFINED | -257 | 37 | Mouse | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
135398745 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
47 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
CHEMBL715 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
DB00334 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
242 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
34 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
60795 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
CHEMBL1112 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
DB01238 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
242 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
34 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
60795 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
CHEMBL1112 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
DB01238 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
4106 | 9280 | 22 | UNDEFINED | -269 | 33 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
5358812 | 9280 | 22 | UNDEFINED | -269 | 33 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
89 | 9280 | 22 | UNDEFINED | -269 | 33 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
CHEMBL93240 | 9280 | 22 | UNDEFINED | -269 | 33 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
1220 | 6975 | 55 | 125I-LSD | -1071 | 44 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
31 | 6975 | 55 | 125I-LSD | -1071 | 44 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
7 | 6975 | 55 | 125I-LSD | -1071 | 44 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
CHEMBL56 | 6975 | 55 | 125I-LSD | -1071 | 44 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
5 | 6927 | 72 | 3H-5CT | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | 3H-5CT | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | 3H-5CT | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | 3H-5CT | -323 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
103 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
2875 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
5736 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
CHEMBL285802 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
DB09225 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
7153 | 104796 | 77 | 3H-LSD | -70 | 33 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
CHEMBL272942 | 104796 | 77 | 3H-LSD | -70 | 33 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
135398745 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
47 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
CHEMBL715 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
DB00334 | 9688 | 112 | 3H-LSD | -109 | 65 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
11954224 | 222732 | 0 | 3H-LSD | -147 | 59 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
1212 | 8443 | 50 | 3H-LSD | -63 | 65 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
204 | 8443 | 50 | 3H-LSD | -63 | 65 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
3372 | 8443 | 50 | 3H-LSD | -63 | 65 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
CHEMBL726 | 8443 | 50 | 3H-LSD | -63 | 65 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
DB00623 | 8443 | 50 | 3H-LSD | -63 | 65 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
4106 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
5358812 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
89 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
CHEMBL93240 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
11954224 | 222732 | 0 | 125I-LSD | -131 | 59 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
1809 | 6922 | 32 | 125I-LSD | -257 | 37 | Mouse | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | 125I-LSD | -257 | 37 | Mouse | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | 125I-LSD | -257 | 37 | Mouse | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4452 | 9538 | 19 | 3H-LSD | -52480 | 18 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | None | |||
983 | 9538 | 19 | 3H-LSD | -52480 | 18 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | None | |||
CHEMBL20734 | 9538 | 19 | 3H-LSD | -52480 | 18 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | None | |||
1220 | 6975 | 55 | UNDEFINED | -1071 | 44 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
31 | 6975 | 55 | UNDEFINED | -1071 | 44 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
7 | 6975 | 55 | UNDEFINED | -1071 | 44 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
CHEMBL56 | 6975 | 55 | UNDEFINED | -1071 | 44 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
None | 222914 | 0 | 3H-LSD | -1819 | 23 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 772 | 16 | 4 | 10 | 5.5 | CN(C)CCONC(=CC=C1C=CC(=O)C=C1)C2=CC=CC=C2F.CN(C)CCONC(=CC=C1C=CC(=O)C=C1)C2=CC=CC=C2F.C(=CC(=O)O)C(=O)O | None | |||
134 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | 125I-LSD | -109 | 67 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
2389 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
5073 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
96 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
CHEMBL85 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
DB00734 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
1809 | 6922 | 32 | 3H-5CT | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | 3H-5CT | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | 3H-5CT | -229 | 37 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
6971132 | 222788 | 0 | 3H-LSD | -512 | 14 | Mouse | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 268 | 1 | 2 | 2 | 2.1 | CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)O | None | |||
1524 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
197 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
3822 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
88 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
CHEMBL51 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
DB12465 | 8962 | 96 | 3H-5CT | -1862 | 51 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
2389 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
5073 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
96 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
CHEMBL85 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
DB00734 | 10104 | 118 | 3H-LSD | -346 | 66 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
1353 | 8692 | 93 | 3H-LSD | -77 | 85 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
3559 | 8692 | 93 | 3H-LSD | -77 | 85 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
86 | 8692 | 93 | 3H-LSD | -77 | 85 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
CHEMBL54 | 8692 | 93 | 3H-LSD | -77 | 85 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
DB00502 | 8692 | 93 | 3H-LSD | -77 | 85 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
242 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
34 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
60795 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
CHEMBL1112 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
DB01238 | 7258 | 124 | 3H-LSD | -144 | 51 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
2337 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
50 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
5002 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
CHEMBL716 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
DB01224 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
1809 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | 125I-LSD | -363 | 37 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
5 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | 125I-LSD | -999 | 53 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
1220 | 6975 | 55 | 3H-5CT | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
31 | 6975 | 55 | 3H-5CT | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
7 | 6975 | 55 | 3H-5CT | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
CHEMBL56 | 6975 | 55 | 3H-5CT | -1548 | 44 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | None | |||
5 | 6927 | 72 | 125I-LSD | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5 | 6927 | 72 | UNDEFINED | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | 125I-LSD | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
5202 | 6927 | 72 | UNDEFINED | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | 125I-LSD | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
CHEMBL39 | 6927 | 72 | UNDEFINED | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | 125I-LSD | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
DB08839 | 6927 | 72 | UNDEFINED | -891 | 53 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | None | |||
115 | 10563 | 80 | 125I-LSD | -61 | 27 | Mouse | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | None | |||
4296 | 10563 | 80 | 125I-LSD | -61 | 27 | Mouse | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | None | |||
CHEMBL274866 | 10563 | 80 | 125I-LSD | -61 | 27 | Mouse | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | None | |||
145 | 6928 | 49 | 3H-LSD | -53 | 30 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 218 | 4 | 1 | 2 | 2.3 | COc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
1832 | 6928 | 49 | 3H-LSD | -53 | 30 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 218 | 4 | 1 | 2 | 2.3 | COc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL7257 | 6928 | 49 | 3H-LSD | -53 | 30 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 218 | 4 | 1 | 2 | 2.3 | COc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB14010 | 6928 | 49 | 3H-LSD | -53 | 30 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 218 | 4 | 1 | 2 | 2.3 | COc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
115237 | 62359 | 119 | 3H-LSD | -181 | 54 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
CHEMBL1621 | 62359 | 119 | 3H-LSD | -181 | 54 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
4106 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
5358812 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
89 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
CHEMBL93240 | 9280 | 22 | 125I-LSD | -128 | 33 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | None | |||
103 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
2875 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
5736 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
CHEMBL285802 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
DB09225 | 10925 | 61 | 3H-LSD | -25 | 53 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
10257 | 7525 | 31 | 3H-LSD | -741 | 19 | Mouse | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
144 | 7525 | 31 | 3H-LSD | -741 | 19 | Mouse | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
CHEMBL416526 | 7525 | 31 | 3H-LSD | -741 | 19 | Mouse | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
DB01445 | 7525 | 31 | 3H-LSD | -741 | 19 | Mouse | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | None | |||
2865 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
59 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
60854 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
CHEMBL708 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
DB00246 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
1588 | 9105 | 27 | 3H-LSD | -8 | 44 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
28864 | 9105 | 27 | 3H-LSD | -8 | 44 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
43 | 9105 | 27 | 3H-LSD | -8 | 44 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
CHEMBL157138 | 9105 | 27 | 3H-LSD | -8 | 44 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
DB00589 | 9105 | 27 | 3H-LSD | -8 | 44 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
11954224 | 222732 | 0 | 125I-LSD | -131 | 59 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
2865 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
59 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
60854 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
CHEMBL708 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
DB00246 | 10915 | 73 | 3H-LSD | -169 | 53 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
2337 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
50 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
5002 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
CHEMBL716 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
DB01224 | 10030 | 77 | 3H-LSD | -38 | 62 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
None | 222725 | 0 | 125I-LSD | -223 | 24 | Mouse | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 346 | 5 | 4 | 4 | 2.5 | COC1=CC2=C(C=C1)NC=C2C3=CCNCC3.C(CC(=O)O)C(=O)O | None | |||
None | 223057 | 0 | 3H-LSD | -3630 | 12 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 426 | 6 | 0 | 6 | 3.4 | C1CCC2C(C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54 | None | |||
11954259 | 222758 | 0 | 3H-LSD | -1202 | 43 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
100 | 10577 | 58 | 3H-LSD | -23 | 54 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
2637 | 10577 | 58 | 3H-LSD | -23 | 54 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
5452 | 10577 | 58 | 3H-LSD | -23 | 54 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
CHEMBL479 | 10577 | 58 | 3H-LSD | -23 | 54 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
DB00679 | 10577 | 58 | 3H-LSD | -23 | 54 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
11954224 | 222732 | 0 | 3H-LSD | -131 | 59 | Mouse | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
135398737 | 7745 | 93 | 3H-LSD | -173 | 90 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
38 | 7745 | 93 | 3H-LSD | -173 | 90 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
722 | 7745 | 93 | 3H-LSD | -173 | 90 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
CHEMBL42 | 7745 | 93 | 3H-LSD | -173 | 90 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
DB00363 | 7745 | 93 | 3H-LSD | -173 | 90 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
3294 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
71360 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
87 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
CHEMBL14376 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
DB04946 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
2470 | 10425 | 50 | None | -77624 | 58 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
3300 | 10425 | 50 | None | -77624 | 58 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
5265 | 10425 | 50 | None | -77624 | 58 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
99 | 10425 | 50 | None | -77624 | 58 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
CHEMBL267930 | 10425 | 50 | None | -77624 | 58 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
1524 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
197 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
3822 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
88 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
CHEMBL51 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
DB12465 | 8962 | 96 | None | -1862 | 51 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
2543 | 10479 | 68 | None | -257 | 32 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
5358 | 10479 | 68 | None | -257 | 32 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
54 | 10479 | 68 | None | -257 | 32 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL128 | 10479 | 68 | None | -257 | 32 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB00669 | 10479 | 68 | None | -257 | 32 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
1342 | 6824 | 49 | 3H-LSD | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | None | |||
3 | 6824 | 49 | 3H-LSD | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | None | |||
CHEMBL277120 | 6824 | 49 | 3H-LSD | -16 | 19 | Mouse | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 212 | 1 | 1 | 2 | 2.2 | N1CCN(CC1)c1cccc2c1cccc2 | None | |||
135398737 | 7745 | 93 | None | -67 | 90 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
38 | 7745 | 93 | None | -67 | 90 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
722 | 7745 | 93 | None | -67 | 90 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
CHEMBL42 | 7745 | 93 | None | -67 | 90 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
DB00363 | 7745 | 93 | None | -67 | 90 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
102 | 10899 | 48 | None | -407 | 49 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | None | -407 | 49 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | None | -407 | 49 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | None | -407 | 49 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | None | -407 | 49 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
216239 | 30567 | 118 | None | -6 | 7 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | None | |||
CHEMBL1200485 | 30567 | 118 | None | -6 | 7 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | None | |||
CHEMBL1336 | 30567 | 118 | None | -6 | 7 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 464 | 5 | 3 | 4 | 5.6 | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | None | |||
2337 | 10030 | 77 | None | -38 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
50 | 10030 | 77 | None | -38 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
5002 | 10030 | 77 | None | -38 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
CHEMBL716 | 10030 | 77 | None | -38 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
DB01224 | 10030 | 77 | None | -38 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
1353 | 8692 | 93 | None | -77 | 85 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
3559 | 8692 | 93 | None | -77 | 85 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
86 | 8692 | 93 | None | -77 | 85 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
CHEMBL54 | 8692 | 93 | None | -77 | 85 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
DB00502 | 8692 | 93 | None | -77 | 85 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
242 | 7258 | 124 | None | -144 | 51 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
34 | 7258 | 124 | None | -144 | 51 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
60795 | 7258 | 124 | None | -144 | 51 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
CHEMBL1112 | 7258 | 124 | None | -144 | 51 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
DB01238 | 7258 | 124 | None | -144 | 51 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
134 | 9292 | 24 | 3H-LSD | -67 | 67 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | 3H-LSD | -67 | 67 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | 3H-LSD | -67 | 67 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | 3H-LSD | -67 | 67 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | 3H-LSD | -67 | 67 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
2543 | 10479 | 68 | 3H-5CT | -1412 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
5358 | 10479 | 68 | 3H-5CT | -1412 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
54 | 10479 | 68 | 3H-5CT | -1412 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
CHEMBL128 | 10479 | 68 | 3H-5CT | -1412 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
DB00669 | 10479 | 68 | 3H-5CT | -1412 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | None | |||
2435 | 10362 | 83 | 3H-LSD | -999 | 48 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
60149 | 10362 | 83 | 3H-LSD | -999 | 48 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
98 | 10362 | 83 | 3H-LSD | -999 | 48 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
CHEMBL12713 | 10362 | 83 | 3H-LSD | -999 | 48 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
DB06144 | 10362 | 83 | 3H-LSD | -999 | 48 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
1809 | 6922 | 32 | 3H-LSD | -257 | 37 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
4 | 6922 | 32 | 3H-LSD | -257 | 37 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
CHEMBL18840 | 6922 | 32 | 3H-LSD | -257 | 37 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | None | |||
3294 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
71360 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
87 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
CHEMBL14376 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
DB04946 | 8787 | 111 | 3H-LSD | -676 | 44 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
277 | 8083 | 62 | 3H-LSD | -69 | 50 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
2913 | 8083 | 62 | 3H-LSD | -69 | 50 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
765 | 8083 | 62 | 3H-LSD | -69 | 50 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
CHEMBL516 | 8083 | 62 | 3H-LSD | -69 | 50 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
DB00434 | 8083 | 62 | 3H-LSD | -69 | 50 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
135398737 | 7745 | 93 | None | -173 | 90 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
38 | 7745 | 93 | None | -173 | 90 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
722 | 7745 | 93 | None | -173 | 90 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
CHEMBL42 | 7745 | 93 | None | -173 | 90 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
DB00363 | 7745 | 93 | None | -173 | 90 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
33630 | 185736 | 99 | None | -13 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
CHEMBL47050 | 185736 | 99 | None | -13 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
102 | 10899 | 48 | None | -1698 | 49 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | None | -1698 | 49 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | None | -1698 | 49 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | None | -1698 | 49 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | None | -1698 | 49 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
5022 | 8432 | 76 | None | -1 | 9 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 390 | 4 | 1 | 4 | 3.2 | O=c1[nH]c2c(n1CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2 | None | |||
6918248 | 8432 | 76 | None | -1 | 9 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 390 | 4 | 1 | 4 | 3.2 | O=c1[nH]c2c(n1CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2 | None | |||
8182 | 8432 | 76 | None | -1 | 9 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 390 | 4 | 1 | 4 | 3.2 | O=c1[nH]c2c(n1CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2 | None | |||
CHEMBL231068 | 8432 | 76 | None | -1 | 9 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 390 | 4 | 1 | 4 | 3.2 | O=c1[nH]c2c(n1CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2 | None | |||
DB04908 | 8432 | 76 | None | -1 | 9 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 390 | 4 | 1 | 4 | 3.2 | O=c1[nH]c2c(n1CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2 | None | |||
1613 | 9127 | 53 | None | -19 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
205 | 9127 | 53 | None | -19 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
3964 | 9127 | 53 | None | -19 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
CHEMBL831 | 9127 | 53 | None | -19 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
DB00408 | 9127 | 53 | None | -19 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
133 | 9274 | 52 | None | -251 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
1723 | 9274 | 52 | None | -251 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
28693 | 9274 | 52 | None | -251 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
CHEMBL19215 | 9274 | 52 | None | -251 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
DB13520 | 9274 | 52 | None | -251 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
11954224 | 222732 | 0 | UNDEFINED | -131 | 59 | Mouse | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
11954224 | 222732 | 0 | 125I-LSD | -131 | 59 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
100 | 10577 | 58 | None | -23 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
2637 | 10577 | 58 | None | -23 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
5452 | 10577 | 58 | None | -23 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
CHEMBL479 | 10577 | 58 | None | -23 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
DB00679 | 10577 | 58 | None | -23 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
212 | 10578 | 47 | None | -6 | 25 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
2639 | 10578 | 47 | None | -6 | 25 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
941651 | 10578 | 47 | None | -6 | 25 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
CHEMBL1201 | 10578 | 47 | None | -6 | 25 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
DB01623 | 10578 | 47 | None | -6 | 25 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
2865 | 10915 | 73 | None | -169 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
59 | 10915 | 73 | None | -169 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
60854 | 10915 | 73 | None | -169 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
CHEMBL708 | 10915 | 73 | None | -169 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
DB00246 | 10915 | 73 | None | -169 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
115237 | 62359 | 119 | None | -181 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
CHEMBL1621 | 62359 | 119 | None | -181 | 54 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
4806 | 10780 | 88 | None | -10 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
7351 | 10780 | 88 | None | -10 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
9966051 | 10780 | 88 | None | -10 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
CHEMBL2104993 | 10780 | 88 | None | -10 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
DB09068 | 10780 | 88 | None | -10 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
2389 | 10104 | 118 | None | -346 | 66 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
5073 | 10104 | 118 | None | -346 | 66 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
96 | 10104 | 118 | None | -346 | 66 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
CHEMBL85 | 10104 | 118 | None | -346 | 66 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
DB00734 | 10104 | 118 | None | -346 | 66 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
134 | 9292 | 24 | None | -109 | 67 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | None | -109 | 67 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | None | -109 | 67 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | None | -109 | 67 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | None | -109 | 67 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1212 | 8443 | 50 | None | -63 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
204 | 8443 | 50 | None | -63 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
3372 | 8443 | 50 | None | -63 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
CHEMBL726 | 8443 | 50 | None | -63 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
DB00623 | 8443 | 50 | None | -63 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
3389 | 224490 | 0 | None | -1 | 26 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 549 | 12 | 0 | 6 | 6.8 | CCCCCCC(=O)OCCN1CCN(CCCN2C3=CC=CC=C3SC3=C2C=C(C=C3)C(F)(F)F)CC1 | None | |||
11978813 | 7508 | 79 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
5014 | 7508 | 79 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
7672 | 7508 | 79 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
CHEMBL2105760 | 7508 | 79 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
DB09128 | 7508 | 79 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
22530 | 62904 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
CHEMBL1600878 | 62904 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
CHEMBL1625607 | 62904 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
2726 | 7706 | 68 | None | -16 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
621 | 7706 | 68 | None | -16 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
83 | 7706 | 68 | None | -16 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
CHEMBL71 | 7706 | 68 | None | -16 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
DB00477 | 7706 | 68 | None | -16 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
141 | 8209 | 35 | 3H-LSD | -7 | 22 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 188 | 3 | 1 | 1 | 2.3 | CN(CCc1c[nH]c2c1cccc2)C | None | |||
6089 | 8209 | 35 | 3H-LSD | -7 | 22 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 188 | 3 | 1 | 1 | 2.3 | CN(CCc1c[nH]c2c1cccc2)C | None | |||
CHEMBL12420 | 8209 | 35 | 3H-LSD | -7 | 22 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 188 | 3 | 1 | 1 | 2.3 | CN(CCc1c[nH]c2c1cccc2)C | None | |||
DB01488 | 8209 | 35 | 3H-LSD | -7 | 22 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 188 | 3 | 1 | 1 | 2.3 | CN(CCc1c[nH]c2c1cccc2)C | None | |||
134 | 9292 | 24 | I125-2-iodo LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | I125-2-iodo LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | I125-2-iodo LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | I125-2-iodo LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | I125-2-iodo LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
134 | 9292 | 24 | 125I-LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | 125I-LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | 125I-LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | 125I-LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | 125I-LSD | -67 | 67 | Mouse | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
133 | 9274 | 52 | 3H-5CT | -251 | 43 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
1723 | 9274 | 52 | 3H-5CT | -251 | 43 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
28693 | 9274 | 52 | 3H-5CT | -251 | 43 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
CHEMBL19215 | 9274 | 52 | 3H-5CT | -251 | 43 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
DB13520 | 9274 | 52 | 3H-5CT | -251 | 43 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
102 | 10899 | 48 | UNDEFINED | -1698 | 49 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
3659 | 10899 | 48 | UNDEFINED | -1698 | 49 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
8969 | 10899 | 48 | UNDEFINED | -1698 | 49 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
CHEMBL15245 | 10899 | 48 | UNDEFINED | -1698 | 49 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
DB01392 | 10899 | 48 | UNDEFINED | -1698 | 49 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | None | |||
2470 | 10425 | 50 | 3H-5CT | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
3300 | 10425 | 50 | 3H-5CT | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
5265 | 10425 | 50 | 3H-5CT | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
99 | 10425 | 50 | 3H-5CT | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
CHEMBL267930 | 10425 | 50 | 3H-5CT | -77624 | 58 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
107780 | 8625 | 54 | 3H-5HT | -6760 | 18 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 497 | 6 | 1 | 7 | 5.0 | COc1ccc(cc1N1CCN(CC1)C)NC(=O)c1ccc(cc1)c1ccc(cc1C)c1noc(n1)C | None | |||
14 | 8625 | 54 | 3H-5HT | -6760 | 18 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 497 | 6 | 1 | 7 | 5.0 | COc1ccc(cc1N1CCN(CC1)C)NC(=O)c1ccc(cc1)c1ccc(cc1C)c1noc(n1)C | None | |||
CHEMBL15928 | 8625 | 54 | 3H-5HT | -6760 | 18 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 497 | 6 | 1 | 7 | 5.0 | COc1ccc(cc1N1CCN(CC1)C)NC(=O)c1ccc(cc1)c1ccc(cc1C)c1noc(n1)C | None | |||
134 | 9292 | 24 | None | -162 | 67 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | None | -162 | 67 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | None | -162 | 67 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | None | -162 | 67 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | None | -162 | 67 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
134 | 9292 | 24 | None | -67 | 67 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | None | -67 | 67 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | None | -67 | 67 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | None | -67 | 67 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | None | -67 | 67 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
103 | 10925 | 61 | None | -25 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
2875 | 10925 | 61 | None | -25 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
5736 | 10925 | 61 | None | -25 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
CHEMBL285802 | 10925 | 61 | None | -25 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
DB09225 | 10925 | 61 | None | -25 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
11954224 | 222732 | 0 | None | -147 | 59 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
1613 | 9127 | 53 | 3H-LSD | -19 | 44 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
205 | 9127 | 53 | 3H-LSD | -19 | 44 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
3964 | 9127 | 53 | 3H-LSD | -19 | 44 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
CHEMBL831 | 9127 | 53 | 3H-LSD | -19 | 44 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
DB00408 | 9127 | 53 | 3H-LSD | -19 | 44 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
134 | 9292 | 24 | UNDEFINED | -67 | 67 | Mouse | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1775 | 9292 | 24 | UNDEFINED | -67 | 67 | Mouse | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
9681 | 9292 | 24 | UNDEFINED | -67 | 67 | Mouse | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
CHEMBL1065 | 9292 | 24 | UNDEFINED | -67 | 67 | Mouse | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
DB00247 | 9292 | 24 | UNDEFINED | -67 | 67 | Mouse | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
1621 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
17 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
5761 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
CHEMBL263881 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
DB04829 | 9207 | 17 | None | -27 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
11954224 | 222732 | 0 | None | -131 | 59 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
11954224 | 222732 | 0 | None | -131 | 59 | Mouse | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
46780481 | 114308 | 20 | None | -50 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
9903970 | 114308 | 20 | None | -50 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
CHEMBL3187365 | 114308 | 20 | None | -50 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
CHEMBL3544974 | 114308 | 20 | None | -50 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
1621 | 9207 | 17 | 3H-LSD | -28 | 44 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
17 | 9207 | 17 | 3H-LSD | -28 | 44 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
5761 | 9207 | 17 | 3H-LSD | -28 | 44 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
CHEMBL263881 | 9207 | 17 | 3H-LSD | -28 | 44 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
DB04829 | 9207 | 17 | 3H-LSD | -28 | 44 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
6971132 | 222788 | 0 | 3H-LSD | -2 | 14 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 268 | 1 | 2 | 2 | 2.1 | CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)O | None | |||
4806 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 21486038 | |||
7351 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 21486038 | |||
9966051 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 21486038 | |||
CHEMBL2104993 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 21486038 | |||
DB09068 | 10780 | 88 | None | -10 | 13 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 21486038 | |||
11168182 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 16002289 | |||
264 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 16002289 | |||
CHEMBL1181770 | 10307 | 25 | None | 50 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 511 | 14 | 1 | 3 | 6.5 | CN(CCN(C(=O)CCC1CCCC1)Cc1ccc(cc1)c1ccc(cc1)CNCCc1ccccc1)C | 16002289 | |||
135398745 | 9688 | 112 | None | -109 | 65 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
47 | 9688 | 112 | None | -109 | 65 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
CHEMBL715 | 9688 | 112 | None | -109 | 65 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
DB00334 | 9688 | 112 | None | -109 | 65 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
1524 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
197 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
3822 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
88 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
CHEMBL51 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
DB12465 | 8962 | 96 | None | -1862 | 51 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 7988681 | |||
2543 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
2543 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 8450829 | |||
5358 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
5358 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 8450829 | |||
54 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
54 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 8450829 | |||
CHEMBL128 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
CHEMBL128 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 8450829 | |||
DB00669 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
DB00669 | 10479 | 68 | None | -257 | 32 | Mouse | 4.8 | pKi | None | 4.8 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 8450829 | |||
2303 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
4946 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
564 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
63 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
91536 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
CHEMBL27 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
CHEMBL452861 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
DB00571 | 9961 | 68 | None | -17378 | 26 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | 7988681 | |||
135398737 | 7745 | 93 | None | -67 | 90 | Mouse | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
38 | 7745 | 93 | None | -67 | 90 | Mouse | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
722 | 7745 | 93 | None | -67 | 90 | Mouse | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
CHEMBL42 | 7745 | 93 | None | -67 | 90 | Mouse | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
DB00363 | 7745 | 93 | None | -67 | 90 | Mouse | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
12 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10715164 | |||
6918513 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10715164 | |||
CHEMBL267615 | 8335 | 17 | None | -208 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 246 | 5 | 1 | 2 | 2.8 | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC | 10715164 | |||
6918515 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10715164 | |||
71 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10715164 | |||
CHEMBL7318 | 9390 | 38 | None | -158 | 7 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 294 | 5 | 1 | 2 | 3.9 | COc1ccc2c(c1)c(CCN(C)C)c([nH]2)c1ccccc1 | 10715164 | |||
2543 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
2543 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 7988681 | |||
5358 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
5358 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 7988681 | |||
54 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
54 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 7988681 | |||
CHEMBL128 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
CHEMBL128 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 7988681 | |||
DB00669 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 11343685 | |||
DB00669 | 10479 | 68 | None | -1412 | 32 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 295 | 6 | 2 | 3 | 1.3 | CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 | 7988681 | |||
102 | 10899 | 48 | None | -407 | 49 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 7988681 | |||
3659 | 10899 | 48 | None | -407 | 49 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 7988681 | |||
8969 | 10899 | 48 | None | -407 | 49 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 7988681 | |||
CHEMBL15245 | 10899 | 48 | None | -407 | 49 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 7988681 | |||
DB01392 | 10899 | 48 | None | -407 | 49 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 7988681 | |||
102 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8450829 | |||
102 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8549774 | |||
3659 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8450829 | |||
3659 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8549774 | |||
8969 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8450829 | |||
8969 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8549774 | |||
CHEMBL15245 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8450829 | |||
CHEMBL15245 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8549774 | |||
DB01392 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8450829 | |||
DB01392 | 10899 | 48 | None | -1698 | 49 | Mouse | 5.5 | pKi | None | 5.5 | Binding | Guide to Pharmacology | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 8549774 | |||
115 | 10563 | 80 | None | -61 | 27 | Mouse | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | 8450829 | |||
4296 | 10563 | 80 | None | -61 | 27 | Mouse | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | 8450829 | |||
CHEMBL274866 | 10563 | 80 | None | -61 | 27 | Mouse | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 230 | 1 | 1 | 2 | 2.1 | FC(c1cccc(c1)N1CCNCC1)(F)F | 8450829 | |||
10257 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8450829 | |||
10257 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8549774 | |||
144 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8450829 | |||
144 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8549774 | |||
CHEMBL416526 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8450829 | |||
CHEMBL416526 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8549774 | |||
DB01445 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8450829 | |||
DB01445 | 7525 | 31 | None | -741 | 19 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 204 | 3 | 2 | 2 | 2.0 | CN(CCc1c[nH]c2c1cc(O)cc2)C | 8549774 | |||
1220 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
1220 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 7988681 | |||
31 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
31 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 7988681 | |||
7 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
7 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 7988681 | |||
CHEMBL56 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
CHEMBL56 | 6975 | 55 | None | -1548 | 44 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 7988681 | |||
122130461 | 9206 | 0 | None | -1584 | 2 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 268 | 1 | 2 | 2 | 2.1 | CN1C[C@@H](C=C2C1Cc1c[nH]c3c1c2ccc3)C(=O)O | 8549774 | |||
139 | 9206 | 0 | None | -1584 | 2 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 268 | 1 | 2 | 2 | 2.1 | CN1C[C@@H](C=C2C1Cc1c[nH]c3c1c2ccc3)C(=O)O | 8549774 | |||
6717 | 9206 | 0 | None | -1584 | 2 | Mouse | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 268 | 1 | 2 | 2 | 2.1 | CN1C[C@@H](C=C2C1Cc1c[nH]c3c1c2ccc3)C(=O)O | 8549774 | |||
1220 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
1220 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 8450829 | |||
31 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
31 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 8450829 | |||
7 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
7 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 8450829 | |||
CHEMBL56 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 11343685 | |||
CHEMBL56 | 6975 | 55 | None | -1071 | 44 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)c(O)ccc2)CCC | 8450829 | |||
108029 | 10187 | 57 | None | -1000 | 13 | Human | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 7988681 | |||
23 | 10187 | 57 | None | -1000 | 13 | Human | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 7988681 | |||
CHEMBL18785 | 10187 | 57 | None | -1000 | 13 | Human | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 7988681 | |||
197706 | 8246 | 0 | None | -3981 | 10 | Human | 6.1 | pKi | None | 6.1 | Binding | Guide to Pharmacology | 403 | 6 | 2 | 5 | 2.3 | NCCc1c[nH]c2c1cc(OCC(=O)N1CCN(CC1)c1ccc(cc1)C#N)cc2 | 10381763 | |||
39 | 8246 | 0 | None | -3981 | 10 | Human | 6.1 | pKi | None | 6.1 | Binding | Guide to Pharmacology | 403 | 6 | 2 | 5 | 2.3 | NCCc1c[nH]c2c1cc(OCC(=O)N1CCN(CC1)c1ccc(cc1)C#N)cc2 | 10381763 | |||
CHEMBL1742428 | 8246 | 0 | None | -3981 | 10 | Human | 6.1 | pKi | None | 6.1 | Binding | Guide to Pharmacology | 403 | 6 | 2 | 5 | 2.3 | NCCc1c[nH]c2c1cc(OCC(=O)N1CCN(CC1)c1ccc(cc1)C#N)cc2 | 10381763 | |||
133 | 9274 | 52 | None | -251 | 43 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | 7988681 | |||
1723 | 9274 | 52 | None | -251 | 43 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | 7988681 | |||
28693 | 9274 | 52 | None | -251 | 43 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | 7988681 | |||
CHEMBL19215 | 9274 | 52 | None | -251 | 43 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | 7988681 | |||
DB13520 | 9274 | 52 | None | -251 | 43 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | 7988681 | |||
135398737 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
135398737 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 7988681 | |||
38 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
38 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 7988681 | |||
722 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
722 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 7988681 | |||
CHEMBL42 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
CHEMBL42 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 7988681 | |||
DB00363 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 11343685 | |||
DB00363 | 7745 | 93 | None | -173 | 90 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 7988681 | |||
5 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
5 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8450829 | |||
5 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8549774 | |||
5202 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
5202 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8450829 | |||
5202 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8549774 | |||
CHEMBL39 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
CHEMBL39 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8450829 | |||
CHEMBL39 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8549774 | |||
DB08839 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
DB08839 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8450829 | |||
DB08839 | 6927 | 72 | None | -891 | 53 | Mouse | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 8549774 | |||
108029 | 10187 | 57 | None | -316 | 13 | Mouse | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 8450829 | |||
23 | 10187 | 57 | None | -316 | 13 | Mouse | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 8450829 | |||
CHEMBL18785 | 10187 | 57 | None | -316 | 13 | Mouse | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 228 | 2 | 2 | 2 | 2.6 | COc1ccc2c(c1)c(c[nH]2)C1=CCNCC1 | 8450829 | |||
5 | 6927 | 72 | None | -999 | 53 | Rat | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7682702 | |||
5202 | 6927 | 72 | None | -999 | 53 | Rat | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7682702 | |||
CHEMBL39 | 6927 | 72 | None | -999 | 53 | Rat | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7682702 | |||
DB08839 | 6927 | 72 | None | -999 | 53 | Rat | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7682702 | |||
134 | 9292 | 24 | None | -109 | 67 | Rat | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7682702 | |||
1775 | 9292 | 24 | None | -109 | 67 | Rat | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7682702 | |||
9681 | 9292 | 24 | None | -109 | 67 | Rat | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7682702 | |||
CHEMBL1065 | 9292 | 24 | None | -109 | 67 | Rat | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7682702 | |||
DB00247 | 9292 | 24 | None | -109 | 67 | Rat | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7682702 | |||
134 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8450829 | |||
134 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8549774 | |||
1775 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8450829 | |||
1775 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8549774 | |||
9681 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8450829 | |||
9681 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8549774 | |||
CHEMBL1065 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8450829 | |||
CHEMBL1065 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8549774 | |||
DB00247 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8450829 | |||
DB00247 | 9292 | 24 | None | -67 | 67 | Mouse | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 8549774 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
5 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7988681 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
5202 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7988681 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
CHEMBL39 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7988681 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 11343685 | |||
DB08839 | 6927 | 72 | None | -323 | 53 | Human | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 176 | 2 | 3 | 2 | 1.4 | NCCc1c[nH]c2c1cc(O)cc2 | 7988681 | |||
4106 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
4106 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 8450829 | |||
5358812 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
5358812 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 8450829 | |||
89 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
89 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 8450829 | |||
CHEMBL93240 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
CHEMBL93240 | 9280 | 22 | None | -269 | 33 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 8450829 | |||
134 | 9292 | 24 | None | -162 | 67 | Human | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7988681 | |||
1775 | 9292 | 24 | None | -162 | 67 | Human | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7988681 | |||
9681 | 9292 | 24 | None | -162 | 67 | Human | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7988681 | |||
CHEMBL1065 | 9292 | 24 | None | -162 | 67 | Human | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7988681 | |||
DB00247 | 9292 | 24 | None | -162 | 67 | Human | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 7988681 | |||
5074 | 10105 | 80 | None | -69 | 30 | Mouse | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
97 | 10105 | 80 | None | -69 | 30 | Mouse | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
CHEMBL267777 | 10105 | 80 | None | -69 | 30 | Mouse | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
DB12693 | 10105 | 80 | None | -69 | 30 | Mouse | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
4106 | 9280 | 22 | None | -128 | 33 | Rat | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7682702 | |||
5358812 | 9280 | 22 | None | -128 | 33 | Rat | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7682702 | |||
89 | 9280 | 22 | None | -128 | 33 | Rat | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7682702 | |||
CHEMBL93240 | 9280 | 22 | None | -128 | 33 | Rat | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7682702 | |||
1809 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
1809 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8450829 | |||
1809 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8549774 | |||
4 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
4 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8450829 | |||
4 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8549774 | |||
CHEMBL18840 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
CHEMBL18840 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8450829 | |||
CHEMBL18840 | 6922 | 32 | None | -257 | 37 | Mouse | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 8549774 | |||
5074 | 10105 | 80 | None | -43 | 30 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
97 | 10105 | 80 | None | -43 | 30 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
CHEMBL267777 | 10105 | 80 | None | -43 | 30 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
DB12693 | 10105 | 80 | None | -43 | 30 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 11343685 | |||
1809 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
1809 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7988681 | |||
4 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
4 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7988681 | |||
CHEMBL18840 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 11343685 | |||
CHEMBL18840 | 6922 | 32 | None | -229 | 37 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7988681 | |||
1043 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
1043 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8450829 | |||
1043 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8549774 | |||
149 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
149 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8450829 | |||
149 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8549774 | |||
8223 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
8223 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8450829 | |||
8223 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8549774 | |||
CHEMBL442 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
CHEMBL442 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8450829 | |||
CHEMBL442 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8549774 | |||
DB00696 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
DB00696 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8450829 | |||
DB00696 | 8363 | 14 | None | -138 | 29 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 8549774 | |||
1809 | 6922 | 32 | None | -363 | 37 | Rat | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7682702 | |||
4 | 6922 | 32 | None | -363 | 37 | Rat | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7682702 | |||
CHEMBL18840 | 6922 | 32 | None | -363 | 37 | Rat | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 203 | 3 | 3 | 2 | 0.8 | NCCc1c[nH]c2c1cc(cc2)C(=O)N | 7682702 | |||
1043 | 8363 | 14 | None | -69 | 29 | Rat | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7682702 | |||
149 | 8363 | 14 | None | -69 | 29 | Rat | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7682702 | |||
8223 | 8363 | 14 | None | -69 | 29 | Rat | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7682702 | |||
CHEMBL442 | 8363 | 14 | None | -69 | 29 | Rat | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7682702 | |||
DB00696 | 8363 | 14 | None | -69 | 29 | Rat | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7682702 | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
1043 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7988681 | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
149 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7988681 | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
8223 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7988681 | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
CHEMBL442 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7988681 | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 11343685 | |||
DB00696 | 8363 | 14 | None | -169 | 29 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 7988681 | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
4106 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7988681 | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
5358812 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7988681 | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
89 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7988681 | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 11343685 | |||
CHEMBL93240 | 9280 | 22 | None | -14 | 33 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 356 | 2 | 0 | 4 | 4.4 | CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C | 7988681 |