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 |
4157793 | 54046 | 8 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 417 | 5 | 2 | 8 | 2.7 | COc1ccc(C2=NN(c3nc(C(=O)O)cs3)C(O)(C(F)(F)F)C2)c(OC)c1 | nan | ||
CHEMBL1543980 | 54046 | 8 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 417 | 5 | 2 | 8 | 2.7 | COc1ccc(C2=NN(c3nc(C(=O)O)cs3)C(O)(C(F)(F)F)C2)c(OC)c1 | nan | ||
2368939 | 62273 | 9 | None | 1 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 427 | 2 | 0 | 2 | 6.0 | CC(C)(C)c1ccc(-c2c[n+](-c3ccc(Br)cc3)c3n2CCCS3)cc1 | nan | ||
CHEMBL1416660 | 62273 | 9 | None | 1 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 427 | 2 | 0 | 2 | 6.0 | CC(C)(C)c1ccc(-c2c[n+](-c3ccc(Br)cc3)c3n2CCCS3)cc1 | nan | ||
CHEMBL1620142 | 62273 | 9 | None | 1 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 427 | 2 | 0 | 2 | 6.0 | CC(C)(C)c1ccc(-c2c[n+](-c3ccc(Br)cc3)c3n2CCCS3)cc1 | nan | ||
842058 | 35449 | 17 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 343 | 4 | 0 | 4 | 3.0 | Cc1nn(C)c(C)c1CN(C)S(=O)(=O)c1ccc2ccccc2c1 | nan | ||
CHEMBL1377607 | 35449 | 17 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 343 | 4 | 0 | 4 | 3.0 | Cc1nn(C)c(C)c1CN(C)S(=O)(=O)c1ccc2ccccc2c1 | nan | ||
3006170 | 66322 | 7 | None | -2 | 3 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 325 | 3 | 5 | 9 | -1.7 | NC(=S)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ncnc(N)c12 | nan | ||
CHEMBL171699 | 66322 | 7 | None | -2 | 3 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 325 | 3 | 5 | 9 | -1.7 | NC(=S)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ncnc(N)c12 | nan | ||
2323706 | 45910 | 6 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 314 | 8 | 1 | 4 | 3.5 | CC(C)CCOc1cccc(OCC(=O)Nc2ccncc2)c1 | nan | ||
CHEMBL1469379 | 45910 | 6 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 314 | 8 | 1 | 4 | 3.5 | CC(C)CCOc1cccc(OCC(=O)Nc2ccncc2)c1 | nan | ||
53385430 | 95539 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 396 | 5 | 0 | 4 | 4.2 | Fc1ccc(CN2CCN(c3ncc(Cc4ccccc4)cn3)CC2)c(Cl)c1 | nan | ||
CHEMBL2362703 | 95539 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 396 | 5 | 0 | 4 | 4.2 | Fc1ccc(CN2CCN(c3ncc(Cc4ccccc4)cn3)CC2)c(Cl)c1 | nan | ||
4544702 | 54295 | 2 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 448 | 6 | 1 | 5 | 5.9 | O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccc(OCC2CCCO2)cc1 | nan | ||
CHEMBL1545848 | 54295 | 2 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 448 | 6 | 1 | 5 | 5.9 | O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccc(OCC2CCCO2)cc1 | nan | ||
3932658 | 66181 | 7 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 396 | 5 | 1 | 7 | 1.3 | NC(=O)c1ccc(N2CCN(S(=O)(=O)c3cccs3)CC2)c([N+](=O)[O-])c1 | nan | ||
CHEMBL1709973 | 66181 | 7 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 396 | 5 | 1 | 7 | 1.3 | NC(=O)c1ccc(N2CCN(S(=O)(=O)c3cccs3)CC2)c([N+](=O)[O-])c1 | nan | ||
44825951 | 74348 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 376 | 13 | 1 | 4 | 4.6 | CCCCC[C@@H](/C=C/C1C(=O)C=C[C@H]1C/C=C\CCCC(=O)O)OC(C)=O | nan | ||
CHEMBL1899895 | 74348 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 376 | 13 | 1 | 4 | 4.6 | CCCCC[C@@H](/C=C/C1C(=O)C=C[C@H]1C/C=C\CCCC(=O)O)OC(C)=O | nan | ||
729558 | 204477 | 11 | None | 1 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 233 | 3 | 0 | 6 | 1.1 | CCOc1nc(C#N)nc(N2CCCCC2)n1 | nan | ||
CHEMBL571295 | 204477 | 11 | None | 1 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 233 | 3 | 0 | 6 | 1.1 | CCOc1nc(C#N)nc(N2CCCCC2)n1 | nan | ||
10662 | 134296 | 27 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 398 | 3 | 2 | 4 | 3.7 | O=C(C(=O)c1cc(Br)ccc1O)c1cc(Br)ccc1O | nan | ||
CHEMBL366205 | 134296 | 27 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 398 | 3 | 2 | 4 | 3.7 | O=C(C(=O)c1cc(Br)ccc1O)c1cc(Br)ccc1O | nan | ||
1155337 | 48976 | 4 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 490 | 8 | 0 | 8 | 4.8 | O=C(CSc1nnc(Cn2nnc3ccccc32)o1)N(Cc1ccc(Cl)cc1)c1ccccc1 | nan | ||
CHEMBL1497024 | 48976 | 4 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 490 | 8 | 0 | 8 | 4.8 | O=C(CSc1nnc(Cn2nnc3ccccc32)o1)N(Cc1ccc(Cl)cc1)c1ccccc1 | nan | ||
648690 | 38279 | 7 | None | 1 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 354 | 4 | 1 | 4 | 2.8 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccc(N2CCCC2=O)cc1 | nan | ||
CHEMBL1403484 | 38279 | 7 | None | 1 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 354 | 4 | 1 | 4 | 2.8 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccc(N2CCCC2=O)cc1 | nan | ||
24791438 | 66772 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 6 | 0 | 5 | 3.8 | CSc1ccc(C(=O)C2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)cc1 | nan | ||
CHEMBL1734666 | 66772 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 6 | 0 | 5 | 3.8 | CSc1ccc(C(=O)C2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)cc1 | nan | ||
1952659 | 47229 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 379 | 5 | 1 | 7 | 3.9 | O=C(CSc1nnc(-c2cccnc2)s1)Nc1ccnc2ccccc12 | nan | ||
CHEMBL1482468 | 47229 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 379 | 5 | 1 | 7 | 3.9 | O=C(CSc1nnc(-c2cccnc2)s1)Nc1ccnc2ccccc12 | nan | ||
16235315 | 34891 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 422 | 6 | 1 | 4 | 3.5 | CC(CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 | nan | ||
CHEMBL1373162 | 34891 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 422 | 6 | 1 | 4 | 3.5 | CC(CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 | nan | ||
992688 | 41753 | 12 | None | 10 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 372 | 7 | 0 | 8 | 3.3 | COc1cc(CSc2nnnn2-c2ccc(C)cc2)cc(OC)c1OC | nan | ||
CHEMBL1432721 | 41753 | 12 | None | 10 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 372 | 7 | 0 | 8 | 3.3 | COc1cc(CSc2nnnn2-c2ccc(C)cc2)cc(OC)c1OC | nan | ||
6906133 | 115060 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 404 | 9 | 1 | 5 | 4.0 | COc1ccc(/C=N/OCC(=O)NC(c2ccccc2)c2ccccc2)cc1OC | nan | ||
CHEMBL3197447 | 115060 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 404 | 9 | 1 | 5 | 4.0 | COc1ccc(/C=N/OCC(=O)NC(c2ccccc2)c2ccccc2)cc1OC | nan | ||
4969272 | 43396 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 431 | 5 | 1 | 4 | 5.4 | CC(=O)c1ccc(N2CCN(C(S)=Nc3ccc(Oc4ccccc4)cc3)CC2)cc1 | nan | ||
CHEMBL1448690 | 43396 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 431 | 5 | 1 | 4 | 5.4 | CC(=O)c1ccc(N2CCN(C(S)=Nc3ccc(Oc4ccccc4)cc3)CC2)cc1 | nan | ||
647700 | 54452 | 8 | None | 12 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 474 | 8 | 0 | 8 | 4.3 | O=C(CSc1nnc(Cn2nnc3ccccc32)o1)N(Cc1ccc(F)cc1)c1ccccc1 | nan | ||
CHEMBL1547232 | 54452 | 8 | None | 12 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 474 | 8 | 0 | 8 | 4.3 | O=C(CSc1nnc(Cn2nnc3ccccc32)o1)N(Cc1ccc(F)cc1)c1ccccc1 | nan | ||
2405889 | 55603 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 327 | 6 | 1 | 3 | 4.5 | CC(=O)c1c(C)[nH]c(C(=O)COc2cc(C)ccc2C(C)C)c1C | nan | ||
CHEMBL1559053 | 55603 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 327 | 6 | 1 | 3 | 4.5 | CC(=O)c1c(C)[nH]c(C(=O)COc2cc(C)ccc2C(C)C)c1C | nan | ||
135521496 | 95468 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 523 | 6 | 3 | 13 | 1.8 | Nc1nonc1-n1nnc(C(=O)N/N=C/c2cc(Br)ccc2O)c1CSC1=NCCS1 | nan | ||
CHEMBL2359911 | 95468 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 523 | 6 | 3 | 13 | 1.8 | Nc1nonc1-n1nnc(C(=O)N/N=C/c2cc(Br)ccc2O)c1CSC1=NCCS1 | nan | ||
24790899 | 60208 | 1 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 367 | 8 | 0 | 5 | 4.1 | C=CCC1(CC=C)CCCN1C(=O)c1cc(COc2ccc(C)nc2)on1 | nan | ||
CHEMBL1600776 | 60208 | 1 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 367 | 8 | 0 | 5 | 4.1 | C=CCC1(CC=C)CCCN1C(=O)c1cc(COc2ccc(C)nc2)on1 | nan | ||
616573 | 11370 | 26 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
CHEMBL102726 | 11370 | 26 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
CHEMBL1444764 | 11370 | 26 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
49778835 | 73988 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 388 | 6 | 1 | 5 | 4.4 | COc1ccc(CNC(=O)c2cccc3c(-c4cccnc4)coc23)cc1OC | nan | ||
CHEMBL1878609 | 73988 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 388 | 6 | 1 | 5 | 4.4 | COc1ccc(CNC(=O)c2cccc3c(-c4cccnc4)coc23)cc1OC | nan | ||
984148 | 53773 | 4 | None | -1 | 3 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 356 | 6 | 3 | 6 | 3.9 | CCCc1cc(-c2[nH]ncc2-c2ccc(C(=O)OCC)o2)c(O)cc1O | nan | ||
CHEMBL1541596 | 53773 | 4 | None | -1 | 3 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 356 | 6 | 3 | 6 | 3.9 | CCCc1cc(-c2[nH]ncc2-c2ccc(C(=O)OCC)o2)c(O)cc1O | nan | ||
16196350 | 61823 | 2 | None | 48 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccccc1N1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C | nan | ||
3253322 | 61823 | 2 | None | 48 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccccc1N1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C | nan | ||
5773522 | 61823 | 2 | None | 48 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccccc1N1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C | nan | ||
CHEMBL1323872 | 61823 | 2 | None | 48 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccccc1N1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C | nan | ||
CHEMBL1616531 | 61823 | 2 | None | 48 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccccc1N1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C | nan | ||
3146673 | 54792 | 14 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 249 | 3 | 1 | 3 | 3.8 | CC(Nc1ncnc2ccccc12)c1ccccc1 | nan | ||
CHEMBL1550278 | 54792 | 14 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 249 | 3 | 1 | 3 | 3.8 | CC(Nc1ncnc2ccccc12)c1ccccc1 | nan | ||
5153 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
CHEMBL1584044 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
CHEMBL328834 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
1878823 | 203961 | 11 | None | 4 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 262 | 11 | 1 | 2 | 4.9 | CCCCCCCCCCCCn1ccc(=N)cc1 | nan | ||
CHEMBL1544561 | 203961 | 11 | None | 4 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 262 | 11 | 1 | 2 | 4.9 | CCCCCCCCCCCCn1ccc(=N)cc1 | nan | ||
CHEMBL568092 | 203961 | 11 | None | 4 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 262 | 11 | 1 | 2 | 4.9 | CCCCCCCCCCCCn1ccc(=N)cc1 | nan | ||
20968904 | 58337 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 469 | 8 | 1 | 5 | 5.3 | Cc1oc(-c2ccc(Cl)cc2)nc1CSCC(=O)NC1CCN(Cc2ccccc2)CC1 | nan | ||
CHEMBL1583186 | 58337 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 469 | 8 | 1 | 5 | 5.3 | Cc1oc(-c2ccc(Cl)cc2)nc1CSCC(=O)NC1CCN(Cc2ccccc2)CC1 | nan | ||
976991 | 40919 | 9 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 331 | 3 | 1 | 5 | 2.7 | NC(=O)c1cn(-c2ccccc2)nc1-c1cc2ccccc2oc1=O | nan | ||
CHEMBL1425860 | 40919 | 9 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 331 | 3 | 1 | 5 | 2.7 | NC(=O)c1cn(-c2ccccc2)nc1-c1cc2ccccc2oc1=O | nan | ||
24817489 | 31584 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 381 | 6 | 0 | 6 | 3.3 | COCC1CCCN(C(=O)c2cc(COc3ccc4ncccc4c3)on2)C1 | nan | ||
CHEMBL1344808 | 31584 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 381 | 6 | 0 | 6 | 3.3 | COCC1CCCN(C(=O)c2cc(COc3ccc4ncccc4c3)on2)C1 | nan | ||
787494 | 44838 | 10 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 276 | 3 | 1 | 2 | 3.7 | Cc1cc(NC(=O)Cc2ccccc2)c2ccccc2n1 | nan | ||
CHEMBL1460627 | 44838 | 10 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 276 | 3 | 1 | 2 | 3.7 | Cc1cc(NC(=O)Cc2ccccc2)c2ccccc2n1 | nan | ||
51360001 | 95500 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 392 | 3 | 0 | 3 | 6.4 | FC(F)(F)c1ccccc1Cc1c(-c2ccco2)nc2c3ccccc3ccn12 | nan | ||
CHEMBL2361231 | 95500 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 392 | 3 | 0 | 3 | 6.4 | FC(F)(F)c1ccccc1Cc1c(-c2ccco2)nc2c3ccccc3ccn12 | nan | ||
5153 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
CHEMBL1584044 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
CHEMBL328834 | 118729 | 14 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 309 | 3 | 5 | 9 | -2.3 | NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12 | nan | ||
650985 | 49253 | 3 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 297 | 5 | 1 | 6 | 2.4 | COc1ccc(CCNc2c(C)c(C)nc3ncnn23)cc1 | nan | ||
CHEMBL1499501 | 49253 | 3 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 297 | 5 | 1 | 6 | 2.4 | COc1ccc(CCNc2c(C)c(C)nc3ncnn23)cc1 | nan | ||
404407 | 66995 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 356 | 2 | 0 | 2 | 3.4 | CN(C)c1ccc(C=c2c3ccccc3n3c2c2c([n+]3C)CCCC2)cc1 | nan | ||
5472654 | 66995 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 356 | 2 | 0 | 2 | 3.4 | CN(C)c1ccc(C=c2c3ccccc3n3c2c2c([n+]3C)CCCC2)cc1 | nan | ||
CHEMBL1721330 | 66995 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 356 | 2 | 0 | 2 | 3.4 | CN(C)c1ccc(C=c2c3ccccc3n3c2c2c([n+]3C)CCCC2)cc1 | nan | ||
CHEMBL1740248 | 66995 | 2 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 356 | 2 | 0 | 2 | 3.4 | CN(C)c1ccc(C=c2c3ccccc3n3c2c2c([n+]3C)CCCC2)cc1 | nan | ||
2766344 | 39401 | 17 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 496 | 10 | 0 | 8 | 3.6 | COC(=O)C1CCN(Cc2ccc(OCCCN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2)CC1 | nan | ||
CHEMBL1412887 | 39401 | 17 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 496 | 10 | 0 | 8 | 3.6 | COC(=O)C1CCN(Cc2ccc(OCCCN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2)CC1 | nan | ||
3306 | 213040 | 39 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 181 | 4 | 3 | 3 | 1.0 | CCNCC(O)c1cccc(O)c1 | nan | ||
CHEMBL86882 | 213040 | 39 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 181 | 4 | 3 | 3 | 1.0 | CCNCC(O)c1cccc(O)c1 | nan | ||
2800172 | 43837 | 8 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 347 | 4 | 1 | 4 | 4.8 | CC(C)(C)c1ccc(C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1 | nan | ||
CHEMBL1452130 | 43837 | 8 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 347 | 4 | 1 | 4 | 4.8 | CC(C)(C)c1ccc(C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1 | nan | ||
9261962 | 32997 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 400 | 7 | 0 | 7 | 2.6 | CC(C)c1ccc(CN2CCN(C(=O)CSc3nnnn3C3CC3)CC2)cc1 | nan | ||
CHEMBL1357535 | 32997 | 5 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 400 | 7 | 0 | 7 | 2.6 | CC(C)c1ccc(CN2CCN(C(=O)CSc3nnnn3C3CC3)CC2)cc1 | nan | ||
49786188 | 73907 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 370 | 8 | 2 | 6 | 3.7 | O=C(Nc1ccc(Oc2ccccc2)cc1)c1csc(COCCO)n1 | nan | ||
CHEMBL1875054 | 73907 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 370 | 8 | 2 | 6 | 3.7 | O=C(Nc1ccc(Oc2ccccc2)cc1)c1csc(COCCO)n1 | nan | ||
646459 | 43688 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 371 | 5 | 1 | 5 | 3.9 | O=C(CN1CCC(c2nc3ccccc3s2)CC1)NCc1cccs1 | nan | ||
CHEMBL1451015 | 43688 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 371 | 5 | 1 | 5 | 3.9 | O=C(CN1CCC(c2nc3ccccc3s2)CC1)NCc1cccs1 | nan | ||
743662 | 66536 | 12 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 300 | 2 | 0 | 2 | 4.2 | Cc1nc2ccccc2n1Cc1ccc(Br)cc1 | nan | ||
CHEMBL1725453 | 66536 | 12 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 300 | 2 | 0 | 2 | 4.2 | Cc1nc2ccccc2n1Cc1ccc(Br)cc1 | nan | ||
1254286 | 39924 | 7 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 334 | 4 | 1 | 3 | 3.5 | Cc1cc(OCC(=O)Nc2ccncc2)c(C)cc1Br | nan | ||
CHEMBL1417355 | 39924 | 7 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 334 | 4 | 1 | 3 | 3.5 | Cc1cc(OCC(=O)Nc2ccncc2)c(C)cc1Br | nan | ||
2374706 | 58192 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 501 | 7 | 2 | 6 | 5.2 | COc1ccc(-c2csc(NC(=O)c3ccccc3NS(=O)(=O)c3ccc(F)c(F)c3)n2)cc1 | nan | ||
CHEMBL1581949 | 58192 | 6 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 501 | 7 | 2 | 6 | 5.2 | COc1ccc(-c2csc(NC(=O)c3ccccc3NS(=O)(=O)c3ccc(F)c(F)c3)n2)cc1 | nan | ||
2795668 | 36458 | 5 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 416 | 2 | 1 | 3 | 4.5 | Fc1ccc(N=C(S)N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)c(F)c1 | nan | ||
CHEMBL1386344 | 36458 | 5 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 416 | 2 | 1 | 3 | 4.5 | Fc1ccc(N=C(S)N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)c(F)c1 | nan | ||
655948 | 33396 | 7 | None | 17 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 351 | 2 | 0 | 8 | 2.4 | Cc1cc(N2CCN(c3nc4ccccc4s3)CC2)n2ncnc2n1 | nan | ||
CHEMBL1361461 | 33396 | 7 | None | 17 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 351 | 2 | 0 | 8 | 2.4 | Cc1cc(N2CCN(c3nc4ccccc4s3)CC2)n2ncnc2n1 | nan | ||
24793159 | 44946 | 2 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 377 | 3 | 1 | 5 | 3.7 | Cn1nccc1C(=O)NC1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 | nan | ||
CHEMBL1461631 | 44946 | 2 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 377 | 3 | 1 | 5 | 3.7 | Cn1nccc1C(=O)NC1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 | nan | ||
657154 | 58890 | 12 | None | 6 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 467 | 6 | 2 | 5 | 5.3 | Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1 | nan | ||
CHEMBL1587630 | 58890 | 12 | None | 6 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 467 | 6 | 2 | 5 | 5.3 | Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1 | nan | ||
51360013 | 95467 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 434 | 3 | 0 | 3 | 6.3 | Cc1cc(Br)cn2c(Cc3ccccc3C(F)(F)F)c(-c3ccco3)nc12 | nan | ||
CHEMBL2359888 | 95467 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 434 | 3 | 0 | 3 | 6.3 | Cc1cc(Br)cn2c(Cc3ccccc3C(F)(F)F)c(-c3ccco3)nc12 | nan | ||
1966784 | 27511 | 8 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 6 | 2 | 6 | 3.9 | CCOC(=O)c1[nH]c2ccc(OC)cc2c1NS(=O)(=O)c1ccc(Cl)s1 | nan | ||
CHEMBL1309273 | 27511 | 8 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 6 | 2 | 6 | 3.9 | CCOC(=O)c1[nH]c2ccc(OC)cc2c1NS(=O)(=O)c1ccc(Cl)s1 | nan | ||
9551471 | 28567 | 10 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 478 | 7 | 1 | 7 | 2.6 | CCCCCn1c(=O)[nH]c2cc(C(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)ccc2c1=O | nan | ||
CHEMBL1319304 | 28567 | 10 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 478 | 7 | 1 | 7 | 2.6 | CCCCCn1c(=O)[nH]c2cc(C(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)ccc2c1=O | nan | ||
24819530 | 54081 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 395 | 5 | 0 | 7 | 3.0 | COC(=O)C1CCCCN1C(=O)c1cc(COc2cccc3cnccc23)on1 | nan | ||
CHEMBL1544190 | 54081 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 395 | 5 | 0 | 7 | 3.0 | COC(=O)C1CCCCN1C(=O)c1cc(COc2cccc3cnccc23)on1 | nan | ||
243725 | 103893 | 36 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 396 | 3 | 0 | 6 | 3.8 | COc1cc2c(cc1OC)[C@@H]1C(=O)c3ccc4c(c3O[C@@H]1CO2)C[C@H](C(C)C)O4 | nan | ||
CHEMBL267630 | 103893 | 36 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 396 | 3 | 0 | 6 | 3.8 | COc1cc2c(cc1OC)[C@@H]1C(=O)c3ccc4c(c3O[C@@H]1CO2)C[C@H](C(C)C)O4 | nan | ||
2795769 | 33701 | 5 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 427 | 3 | 1 | 5 | 4.9 | Cc1c(Cl)cccc1NC(=O)N1CCCN(c2nc(-c3ccccc3)ns2)CC1 | nan | ||
CHEMBL1364108 | 33701 | 5 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 427 | 3 | 1 | 5 | 4.9 | Cc1c(Cl)cccc1NC(=O)N1CCCN(c2nc(-c3ccccc3)ns2)CC1 | nan | ||
2356907 | 49238 | 6 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 343 | 2 | 1 | 3 | 4.0 | Cc1nn(C)c(Nc2ccc(Br)cc2)c1Br | nan | ||
CHEMBL1499354 | 49238 | 6 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 343 | 2 | 1 | 3 | 4.0 | Cc1nn(C)c(Nc2ccc(Br)cc2)c1Br | nan | ||
2537601 | 50911 | 6 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 422 | 10 | 2 | 8 | 2.0 | COc1cc(CCC(=O)OCC(=O)Nc2sccc2C(N)=O)cc(OC)c1OC | nan | ||
CHEMBL1515567 | 50911 | 6 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 422 | 10 | 2 | 8 | 2.0 | COc1cc(CCC(=O)OCC(=O)Nc2sccc2C(N)=O)cc(OC)c1OC | nan | ||
3155818 | 50473 | 8 | None | 5 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 368 | 8 | 1 | 6 | 3.4 | CCCOC(=O)c1ccc(OCC(O)Cn2c(C)nc3ccccc32)cc1 | nan | ||
CHEMBL1510261 | 50473 | 8 | None | 5 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 368 | 8 | 1 | 6 | 3.4 | CCCOC(=O)c1ccc(OCC(O)Cn2c(C)nc3ccccc32)cc1 | nan | ||
1231799 | 31034 | 11 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 297 | 3 | 1 | 3 | 3.0 | Cc1nn(C)c(C(=O)NCc2ccc(Cl)cc2)c1Cl | nan | ||
CHEMBL1340112 | 31034 | 11 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 297 | 3 | 1 | 3 | 3.0 | Cc1nn(C)c(C(=O)NCc2ccc(Cl)cc2)c1Cl | nan | ||
2318546 | 66072 | 8 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 334 | 6 | 1 | 4 | 4.2 | Cc1ccc(Oc2ccc(OCC(=O)Nc3ccncc3)cc2)cc1 | nan | ||
CHEMBL1705098 | 66072 | 8 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 334 | 6 | 1 | 4 | 4.2 | Cc1ccc(Oc2ccc(OCC(=O)Nc3ccncc3)cc2)cc1 | nan | ||
187 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
294 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
65 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
8593 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
CHEMBL667 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
DB03128 | 7043 | 39 | None | -22 | 8 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
2349797 | 34337 | 8 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 307 | 4 | 2 | 2 | 3.8 | S=C(NCCc1ccccc1)Nc1cccc2cnccc12 | nan | ||
CHEMBL1369262 | 34337 | 8 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 307 | 4 | 2 | 2 | 3.8 | S=C(NCCc1ccccc1)Nc1cccc2cnccc12 | nan | ||
5613808 | 46069 | 9 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 214 | 1 | 2 | 5 | 1.2 | O=[N+]([O-])c1[nH]c2nc(O)nc-2cc1Cl | nan | ||
CHEMBL1470764 | 46069 | 9 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 214 | 1 | 2 | 5 | 1.2 | O=[N+]([O-])c1[nH]c2nc(O)nc-2cc1Cl | nan | ||
51360490 | 73872 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 1059 | 8 | 1 | 13 | 5.2 | CC[C@H](C)C1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](COC)C(=O)N2CCC[C@H]2C(=O)N(C)[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)O[C@H](CC)CCC[C@@H](O)[C@@H](C)C(=O)O[C@H](C)[C@@H](C)C/C=C(C)/C(OC)=C\C(=O)N1C | nan | ||
CHEMBL1873644 | 73872 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 1059 | 8 | 1 | 13 | 5.2 | CC[C@H](C)C1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](COC)C(=O)N2CCC[C@H]2C(=O)N(C)[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)O[C@H](CC)CCC[C@@H](O)[C@@H](C)C(=O)O[C@H](C)[C@@H](C)C/C=C(C)/C(OC)=C\C(=O)N1C | nan | ||
2874826 | 36497 | 12 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 276 | 3 | 1 | 5 | 1.5 | CC1CC(=O)NN=C1c1ccc(N(C)C)c([N+](=O)[O-])c1 | nan | ||
CHEMBL1386646 | 36497 | 12 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 276 | 3 | 1 | 5 | 1.5 | CC1CC(=O)NN=C1c1ccc(N(C)C)c([N+](=O)[O-])c1 | nan | ||
823638 | 60552 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 278 | 4 | 1 | 3 | 3.3 | O=C(COc1ccc2ccccc2c1)Nc1ccncc1 | nan | ||
CHEMBL1603921 | 60552 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 278 | 4 | 1 | 3 | 3.3 | O=C(COc1ccc2ccccc2c1)Nc1ccncc1 | nan | ||
2426360 | 53661 | 6 | None | 8 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 382 | 3 | 3 | 3 | 4.6 | Fc1ccc(N=C(S)NNc2ncc(C(F)(F)F)cc2Cl)c(F)c1 | nan | ||
CHEMBL1540808 | 53661 | 6 | None | 8 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 382 | 3 | 3 | 3 | 4.6 | Fc1ccc(N=C(S)NNc2ncc(C(F)(F)F)cc2Cl)c(F)c1 | nan | ||
714273 | 29623 | 12 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 244 | 2 | 0 | 6 | 0.9 | N#Cc1nc(N2CCCC2)nc(N2CCCC2)n1 | nan | ||
CHEMBL1328481 | 29623 | 12 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 244 | 2 | 0 | 6 | 0.9 | N#Cc1nc(N2CCCC2)nc(N2CCCC2)n1 | nan | ||
2811299 | 51594 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 315 | 3 | 1 | 5 | 2.4 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccc2c(c1)OCO2 | nan | ||
CHEMBL1522108 | 51594 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 315 | 3 | 1 | 5 | 2.4 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccc2c(c1)OCO2 | nan | ||
1126136 | 62619 | 13 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 371 | 5 | 0 | 5 | 3.3 | CSc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 | nan | ||
CHEMBL1522672 | 62619 | 13 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 371 | 5 | 0 | 5 | 3.3 | CSc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 | nan | ||
CHEMBL1623172 | 62619 | 13 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 371 | 5 | 0 | 5 | 3.3 | CSc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 | nan | ||
660194 | 38974 | 17 | None | 6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 319 | 8 | 1 | 7 | 1.6 | C=CCNc1nc2c(c(=O)n(C)c(=O)n2C)n1CCCCCC | nan | ||
CHEMBL1409445 | 38974 | 17 | None | 6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 319 | 8 | 1 | 7 | 1.6 | C=CCNc1nc2c(c(=O)n(C)c(=O)n2C)n1CCCCCC | nan | ||
1599306 | 20927 | 7 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 220 | 8 | 1 | 2 | 3.7 | CCCCCCCCCn1ccc(=N)cc1 | nan | ||
CHEMBL1198353 | 20927 | 7 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 220 | 8 | 1 | 2 | 3.7 | CCCCCCCCCn1ccc(=N)cc1 | nan | ||
CHEMBL601933 | 20927 | 7 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 220 | 8 | 1 | 2 | 3.7 | CCCCCCCCCn1ccc(=N)cc1 | nan | ||
646580 | 37150 | 5 | None | 6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 382 | 5 | 3 | 7 | 1.9 | CC(C)(C)NC(=O)COC(=O)c1snc(C(=O)NC2CCCCC2)c1N | nan | ||
CHEMBL1392033 | 37150 | 5 | None | 6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 382 | 5 | 3 | 7 | 1.9 | CC(C)(C)NC(=O)COC(=O)c1snc(C(=O)NC2CCCCC2)c1N | nan | ||
3237192 | 54273 | 3 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 424 | 6 | 1 | 5 | 4.2 | Cc1oc(-c2ccc(Cl)cc2)nc1CN1CCCC(C(=O)NCc2cccnc2)C1 | nan | ||
CHEMBL1545631 | 54273 | 3 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 424 | 6 | 1 | 5 | 4.2 | Cc1oc(-c2ccc(Cl)cc2)nc1CN1CCCC(C(=O)NCc2cccnc2)C1 | nan | ||
69765 | 91903 | 74 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 251 | 1 | 1 | 3 | 3.9 | CC(C)(C)c1cc([N+](=O)[O-])cc(C(C)(C)C)c1O | nan | ||
CHEMBL224869 | 91903 | 74 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 251 | 1 | 1 | 3 | 3.9 | CC(C)(C)c1cc([N+](=O)[O-])cc(C(C)(C)C)c1O | nan | ||
20968908 | 26387 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 528 | 11 | 1 | 6 | 3.9 | Cc1oc(-c2ccc(Cl)cc2)nc1C[S+]([O-])CC(=O)NCCCN1CCN(Cc2ccccc2)CC1 | nan | ||
CHEMBL1300302 | 26387 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 528 | 11 | 1 | 6 | 3.9 | Cc1oc(-c2ccc(Cl)cc2)nc1C[S+]([O-])CC(=O)NCCCN1CCN(Cc2ccccc2)CC1 | nan | ||
71821 | 52075 | 40 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 256 | 2 | 0 | 2 | 4.0 | Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | nan | ||
CHEMBL152649 | 52075 | 40 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 256 | 2 | 0 | 2 | 4.0 | Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | nan | ||
936105 | 52931 | 12 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 332 | 4 | 1 | 4 | 2.4 | O=S(=O)(NCc1ccncc1)c1ccc(Br)s1 | nan | ||
CHEMBL1534042 | 52931 | 12 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 332 | 4 | 1 | 4 | 2.4 | O=S(=O)(NCc1ccncc1)c1ccc(Br)s1 | nan | ||
3236301 | 44293 | 11 | None | 4 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 262 | 1 | 1 | 7 | -0.3 | CCc1nc2c([nH]1)c1no[n+]([O-])c1c1no[n+]([O-])c21 | nan | ||
CHEMBL1455957 | 44293 | 11 | None | 4 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 262 | 1 | 1 | 7 | -0.3 | CCc1nc2c([nH]1)c1no[n+]([O-])c1c1no[n+]([O-])c21 | nan | ||
2100274 | 31493 | 2 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 418 | 3 | 0 | 8 | 2.0 | O=S(=O)(c1ccc2c(c1)OCCO2)N1CCN(c2ncnc3sccc23)CC1 | nan | ||
CHEMBL1344025 | 31493 | 2 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 418 | 3 | 0 | 8 | 2.0 | O=S(=O)(c1ccc2c(c1)OCCO2)N1CCN(c2ncnc3sccc23)CC1 | nan | ||
2795678 | 58498 | 5 | None | 4 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 434 | 2 | 1 | 4 | 5.7 | Cc1cccc(Cl)c1NC(=O)N1CCCN(c2nc3ccc(Cl)cc3s2)CC1 | nan | ||
CHEMBL1584471 | 58498 | 5 | None | 4 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 434 | 2 | 1 | 4 | 5.7 | Cc1cccc(Cl)c1NC(=O)N1CCCN(c2nc3ccc(Cl)cc3s2)CC1 | nan | ||
2738599 | 51824 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 427 | 6 | 1 | 4 | 3.1 | CN1CCN(c2ccc(CNS(=O)(=O)Cc3cccc(C(F)(F)F)c3)cc2)CC1 | nan | ||
CHEMBL1524322 | 51824 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 427 | 6 | 1 | 4 | 3.1 | CN1CCN(c2ccc(CNS(=O)(=O)Cc3cccc(C(F)(F)F)c3)cc2)CC1 | nan | ||
3323365 | 46789 | 15 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 347 | 3 | 1 | 4 | 4.4 | Cc1nn(C)c(Cl)c1NC(=O)OCc1ccc(Cl)cc1Cl | nan | ||
CHEMBL1478769 | 46789 | 15 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 347 | 3 | 1 | 4 | 4.4 | Cc1nn(C)c(Cl)c1NC(=O)OCc1ccc(Cl)cc1Cl | nan | ||
3237836 | 51748 | 8 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 297 | 3 | 1 | 6 | 3.1 | N#CCSc1nc(N)c(C#N)c(C2CCCCC2)c1C#N | nan | ||
CHEMBL1523520 | 51748 | 8 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 297 | 3 | 1 | 6 | 3.1 | N#CCSc1nc(N)c(C#N)c(C2CCCCC2)c1C#N | nan | ||
663916 | 44999 | 8 | None | 3 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 259 | 4 | 1 | 3 | 3.4 | CCCCOc1[nH]cnc2c3cc(F)ccc3nc1-2 | nan | ||
CHEMBL1462076 | 44999 | 8 | None | 3 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 259 | 4 | 1 | 3 | 3.4 | CCCCOc1[nH]cnc2c3cc(F)ccc3nc1-2 | nan | ||
1653621 | 29251 | 21 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 298 | 6 | 1 | 3 | 4.6 | CCCOc1ccc(CSc2nc3ccccc3[nH]2)cc1 | nan | ||
CHEMBL1325226 | 29251 | 21 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 298 | 6 | 1 | 3 | 4.6 | CCCOc1ccc(CSc2nc3ccccc3[nH]2)cc1 | nan | ||
4352110 | 33355 | 7 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 422 | 3 | 4 | 9 | 2.3 | COc1ccc(C2CC(=O)Nc3sc(=N)c4c(N)c(C#N)c(N)nc4c32)cc1OC | nan | ||
CHEMBL1361038 | 33355 | 7 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 422 | 3 | 4 | 9 | 2.3 | COc1ccc(C2CC(=O)Nc3sc(=N)c4c(N)c(C#N)c(N)nc4c32)cc1OC | nan | ||
24793944 | 48531 | 2 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 357 | 3 | 1 | 5 | 2.7 | Cn1nccc1C(=O)NC1CCCc2c1cnn2-c1ccc(F)cc1F | nan | ||
CHEMBL1492752 | 48531 | 2 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 357 | 3 | 1 | 5 | 2.7 | Cn1nccc1C(=O)NC1CCCc2c1cnn2-c1ccc(F)cc1F | nan | ||
616573 | 11370 | 26 | None | 2 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
CHEMBL102726 | 11370 | 26 | None | 2 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
CHEMBL1444764 | 11370 | 26 | None | 2 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 235 | 3 | 1 | 3 | 3.2 | c1ccc(CNc2ncnc3ccccc23)cc1 | nan | ||
16196224 | 62258 | 2 | None | 51 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccc(N2C(C)=CC(=Cc3sc4ccccc4[n+]3C)C=C2C)cc1 | nan | ||
2320816 | 62258 | 2 | None | 51 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccc(N2C(C)=CC(=Cc3sc4ccccc4[n+]3C)C=C2C)cc1 | nan | ||
5668087 | 62258 | 2 | None | 51 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccc(N2C(C)=CC(=Cc3sc4ccccc4[n+]3C)C=C2C)cc1 | nan | ||
CHEMBL1422429 | 62258 | 2 | None | 51 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccc(N2C(C)=CC(=Cc3sc4ccccc4[n+]3C)C=C2C)cc1 | nan | ||
CHEMBL1620064 | 62258 | 2 | None | 51 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 375 | 3 | 0 | 3 | 5.4 | COc1ccc(N2C(C)=CC(=Cc3sc4ccccc4[n+]3C)C=C2C)cc1 | nan | ||
3111187 | 54321 | 41 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 248 | 2 | 2 | 5 | 1.0 | CC1CC(=O)NN=C1c1ccc(N)c([N+](=O)[O-])c1 | nan | ||
CHEMBL1546066 | 54321 | 41 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 248 | 2 | 2 | 5 | 1.0 | CC1CC(=O)NN=C1c1ccc(N)c([N+](=O)[O-])c1 | nan | ||
1095440 | 50980 | 17 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 359 | 6 | 2 | 3 | 3.7 | CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccccc23)c2ccccc12 | nan | ||
CHEMBL1516566 | 50980 | 17 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 359 | 6 | 2 | 3 | 3.7 | CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccccc23)c2ccccc12 | nan | ||
20919845 | 38114 | 6 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 475 | 8 | 1 | 8 | 2.9 | COc1ccc(OC)c(CCNC(=O)Cn2nc(C)c3c(C)n(-c4ccc(C)cc4)nc3c2=O)c1 | nan | ||
CHEMBL1401965 | 38114 | 6 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 475 | 8 | 1 | 8 | 2.9 | COc1ccc(OC)c(CCNC(=O)Cn2nc(C)c3c(C)n(-c4ccc(C)cc4)nc3c2=O)c1 | nan | ||
16190638 | 60437 | 3 | None | 9 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 375 | 5 | 1 | 4 | 4.0 | CCC1C(=O)NCCN1Cc1nc(-c2ccc(-c3ccccc3)cc2)oc1C | nan | ||
CHEMBL1603032 | 60437 | 3 | None | 9 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 375 | 5 | 1 | 4 | 4.0 | CCC1C(=O)NCCN1Cc1nc(-c2ccc(-c3ccccc3)cc2)oc1C | nan | ||
23723905 | 66410 | 6 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 391 | 6 | 1 | 5 | 3.9 | CC(C)(C)CN1CCN(Cc2nc(-c3ccc(F)cc3)cs2)CC1CCO | nan | ||
CHEMBL1720771 | 66410 | 6 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 391 | 6 | 1 | 5 | 3.9 | CC(C)(C)CN1CCN(Cc2nc(-c3ccc(F)cc3)cs2)CC1CCO | nan | ||
44246639 | 66326 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 484 | 7 | 0 | 7 | 3.7 | Cc1cc(C)c(CN2CCN(C(=O)Cn3cnc4c(OCc5ccccc5)ncnc43)CC2)c(C)c1 | nan | ||
CHEMBL1717082 | 66326 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 484 | 7 | 0 | 7 | 3.7 | Cc1cc(C)c(CN2CCN(C(=O)Cn3cnc4c(OCc5ccccc5)ncnc43)CC2)c(C)c1 | nan | ||
2534514 | 66069 | 5 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 357 | 6 | 2 | 4 | 2.7 | O=C(COC(=O)c1[nH]nc2ccccc12)NCCc1ccc(Cl)cc1 | nan | ||
CHEMBL1705059 | 66069 | 5 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 357 | 6 | 2 | 4 | 2.7 | O=C(COC(=O)c1[nH]nc2ccccc12)NCCc1ccc(Cl)cc1 | nan | ||
135399075 | 26589 | 7 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 420 | 7 | 2 | 8 | 3.7 | Cc1cc(C(=O)CSc2nc(N)cc(O)n2)c(C)n1-c1ccc(OC(F)F)cc1 | nan | ||
CHEMBL1301887 | 26589 | 7 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 420 | 7 | 2 | 8 | 3.7 | Cc1cc(C(=O)CSc2nc(N)cc(O)n2)c(C)n1-c1ccc(OC(F)F)cc1 | nan | ||
1163593 | 60068 | 10 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 481 | 8 | 2 | 6 | 3.6 | COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(CN4CCOCC4)cc3)cc2)cc1 | nan | ||
CHEMBL1599462 | 60068 | 10 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 481 | 8 | 2 | 6 | 3.6 | COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(CN4CCOCC4)cc3)cc2)cc1 | nan | ||
2548270 | 56564 | 9 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 362 | 5 | 2 | 6 | 2.6 | Cc1sc2ncnc(NCCc3ccc(S(N)(=O)=O)cc3)c2c1C | nan | ||
CHEMBL1567331 | 56564 | 9 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 362 | 5 | 2 | 6 | 2.6 | Cc1sc2ncnc(NCCc3ccc(S(N)(=O)=O)cc3)c2c1C | nan | ||
108144 | 214461 | 74 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.2 | NC(=O)c1nnn(Cc2cc(Cl)c(C(=O)c3ccc(Cl)cc3)c(Cl)c2)c1N | nan | ||
CHEMBL95431 | 214461 | 74 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.2 | NC(=O)c1nnn(Cc2cc(Cl)c(C(=O)c3ccc(Cl)cc3)c(Cl)c2)c1N | nan | ||
951643 | 54698 | 9 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 274 | 3 | 0 | 3 | 3.8 | CC(=O)c1cn(Cc2ccccc2C#N)c2ccccc12 | nan | ||
CHEMBL1549500 | 54698 | 9 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 274 | 3 | 0 | 3 | 3.8 | CC(=O)c1cn(Cc2ccccc2C#N)c2ccccc12 | nan | ||
6902566 | 114958 | 3 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 329 | 3 | 2 | 2 | 3.8 | FC(F)(F)c1cccc(/C=N/NC(=S)NC2CCCCC2)c1 | nan | ||
CHEMBL3196315 | 114958 | 3 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 329 | 3 | 2 | 2 | 3.8 | FC(F)(F)c1cccc(/C=N/NC(=S)NC2CCCCC2)c1 | nan | ||
646118 | 38723 | 5 | None | 5 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 311 | 6 | 1 | 6 | 2.7 | CCc1c(C)nc2ncnn2c1NCCc1ccc(OC)cc1 | nan | ||
CHEMBL1407572 | 38723 | 5 | None | 5 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 311 | 6 | 1 | 6 | 2.7 | CCc1c(C)nc2ncnn2c1NCCc1ccc(OC)cc1 | nan | ||
1321677 | 40888 | 9 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 432 | 7 | 1 | 4 | 5.4 | Cc1cc(CSc2ccccc2)ccc1NC(=O)c1ccc(CN2CCOCC2)cc1 | nan | ||
CHEMBL1425552 | 40888 | 9 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 432 | 7 | 1 | 4 | 5.4 | Cc1cc(CSc2ccccc2)ccc1NC(=O)c1ccc(CN2CCOCC2)cc1 | nan | ||
2139165 | 60586 | 14 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 236 | 2 | 0 | 2 | 3.7 | Cc1ccccc1Cn1c(C)nc2ccccc21 | nan | ||
CHEMBL1604200 | 60586 | 14 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 236 | 2 | 0 | 2 | 3.7 | Cc1ccccc1Cn1c(C)nc2ccccc21 | nan | ||
135549777 | 115934 | 5 | None | 7 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 471 | 7 | 1 | 9 | 4.1 | C/C(=N\OCc1nc2ccccc2c(=O)n1/N=C/c1cc(C)cc([N+](=O)[O-])c1O)c1ccccc1 | nan | ||
CHEMBL3214310 | 115934 | 5 | None | 7 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 471 | 7 | 1 | 9 | 4.1 | C/C(=N\OCc1nc2ccccc2c(=O)n1/N=C/c1cc(C)cc([N+](=O)[O-])c1O)c1ccccc1 | nan | ||
49778246 | 74390 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 484 | 7 | 2 | 8 | 4.2 | OC[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)C[C@H](n2cnc3c(NC4CCCC4)ncnc32)O1 | nan | ||
CHEMBL1903414 | 74390 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 484 | 7 | 2 | 8 | 4.2 | OC[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)C[C@H](n2cnc3c(NC4CCCC4)ncnc32)O1 | nan | ||
4143977 | 66302 | 5 | None | 2 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 461 | 7 | 1 | 7 | 4.6 | COCC(C)n1c(-c2ccc3c(c2)NC(=O)CO3)cs/c1=N\c1ccc(OC(F)F)cc1 | nan | ||
CHEMBL1716038 | 66302 | 5 | None | 2 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 461 | 7 | 1 | 7 | 4.6 | COCC(C)n1c(-c2ccc3c(c2)NC(=O)CO3)cs/c1=N\c1ccc(OC(F)F)cc1 | nan | ||
16397324 | 49356 | 6 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 435 | 14 | 2 | 4 | 4.8 | CCCCC[C@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N1CCCCC1CO | nan | ||
CHEMBL1500445 | 49356 | 6 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 435 | 14 | 2 | 4 | 4.8 | CCCCC[C@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N1CCCCC1CO | nan | ||
693933 | 54504 | 14 | None | 3 | 3 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 327 | 3 | 1 | 3 | 3.9 | Nc1cc(-c2ccc(Br)cc2)nn1Cc1ccccc1 | nan | ||
CHEMBL1547757 | 54504 | 14 | None | 3 | 3 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 327 | 3 | 1 | 3 | 3.9 | Nc1cc(-c2ccc(Br)cc2)nn1Cc1ccccc1 | nan | ||
24819426 | 58392 | 3 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 435 | 7 | 1 | 5 | 4.9 | COc1ccc(CN2CCC(C(=O)Nc3ccc(Oc4ccccc4)nc3)CC2)cc1F | nan | ||
CHEMBL1583610 | 58392 | 3 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 435 | 7 | 1 | 5 | 4.9 | COc1ccc(CN2CCC(C(=O)Nc3ccc(Oc4ccccc4)nc3)CC2)cc1F | nan | ||
46943517 | 79011 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 431 | 7 | 1 | 5 | 5.4 | COc1ccc(-c2coc3c(C(=O)NCc4ccc(OC)c(OC)c4)cccc23)c(C)c1 | nan | ||
CHEMBL1981589 | 79011 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 431 | 7 | 1 | 5 | 5.4 | COc1ccc(-c2coc3c(C(=O)NCc4ccc(OC)c(OC)c4)cccc23)c(C)c1 | nan | ||
44601539 | 66214 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 483 | 7 | 1 | 7 | 3.7 | Cc1cc(C)c(CN2CCN(C(=O)Cn3cnc4c(NCc5ccccc5)ncnc43)CC2)c(C)c1 | nan | ||
CHEMBL1711360 | 66214 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 483 | 7 | 1 | 7 | 3.7 | Cc1cc(C)c(CN2CCN(C(=O)Cn3cnc4c(NCc5ccccc5)ncnc43)CC2)c(C)c1 | nan | ||
3695590 | 56814 | 13 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 292 | 5 | 3 | 6 | 0.9 | CC1CC(=O)NN=C1c1ccc(NCCO)c([N+](=O)[O-])c1 | nan | ||
CHEMBL1569489 | 56814 | 13 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 292 | 5 | 3 | 6 | 0.9 | CC1CC(=O)NN=C1c1ccc(NCCO)c([N+](=O)[O-])c1 | nan | ||
417935 | 61904 | 2 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 275 | 1 | 0 | 1 | 3.8 | CC1(C)CC(N2CCCCC2)=CC(=[N+]2CCCCC2)C1 | nan | ||
CHEMBL1342790 | 61904 | 2 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 275 | 1 | 0 | 1 | 3.8 | CC1(C)CC(N2CCCCC2)=CC(=[N+]2CCCCC2)C1 | nan | ||
CHEMBL1617098 | 61904 | 2 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 275 | 1 | 0 | 1 | 3.8 | CC1(C)CC(N2CCCCC2)=CC(=[N+]2CCCCC2)C1 | nan | ||
2128618 | 30748 | 6 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 353 | 7 | 0 | 6 | 3.3 | COCCn1c(C)cc(C(=O)COc2nc3ccccc3nc2C)c1C | nan | ||
CHEMBL1337567 | 30748 | 6 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 353 | 7 | 0 | 6 | 3.3 | COCCn1c(C)cc(C(=O)COc2nc3ccccc3nc2C)c1C | nan | ||
135431504 | 51388 | 10 | None | 3 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 308 | 2 | 2 | 7 | 3.3 | Nc1nn2c(O)c3c(nc2c1N=Nc1ccccc1)CCCC3 | nan | ||
CHEMBL1520388 | 51388 | 10 | None | 3 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 308 | 2 | 2 | 7 | 3.3 | Nc1nn2c(O)c3c(nc2c1N=Nc1ccccc1)CCCC3 | nan | ||
2100093 | 40675 | 13 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 315 | 6 | 1 | 6 | 3.4 | COc1ccc(CCNc2ncnc3sccc23)cc1OC | nan | ||
CHEMBL1423660 | 40675 | 13 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 315 | 6 | 1 | 6 | 3.4 | COc1ccc(CCNc2ncnc3sccc23)cc1OC | nan | ||
2326905 | 26419 | 5 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 310 | 4 | 1 | 3 | 4.8 | CNc1ccccc1C(C)(C)c1cc(-c2ccc(F)cc2)no1 | nan | ||
CHEMBL1300536 | 26419 | 5 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 310 | 4 | 1 | 3 | 4.8 | CNc1ccccc1C(C)(C)c1cc(-c2ccc(F)cc2)no1 | nan | ||
663797 | 37922 | 8 | None | 104 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 296 | 2 | 1 | 4 | 3.4 | COc1cccc2[nH]c3c(N4CCC(C)CC4)ncnc3c12 | nan | ||
CHEMBL1400272 | 37922 | 8 | None | 104 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 296 | 2 | 1 | 4 | 3.4 | COc1cccc2[nH]c3c(N4CCC(C)CC4)ncnc3c12 | nan | ||
4323685 | 66424 | 8 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 396 | 3 | 0 | 6 | 3.8 | COc1cc2c(cc1OC)C1C(=O)c3ccc4c(c3OC1CO2)CC(C(C)C)O4 | nan | ||
CHEMBL1721226 | 66424 | 8 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 396 | 3 | 0 | 6 | 3.8 | COc1cc2c(cc1OC)C1C(=O)c3ccc4c(c3OC1CO2)CC(C(C)C)O4 | nan | ||
944164 | 41245 | 8 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 292 | 4 | 2 | 3 | 4.4 | C1=C(CCNc2[nH]cnc3c4ccccc4nc2-3)CCCC1 | nan | ||
CHEMBL1428566 | 41245 | 8 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 292 | 4 | 2 | 3 | 4.4 | C1=C(CCNc2[nH]cnc3c4ccccc4nc2-3)CCCC1 | nan | ||
3548924 | 34702 | 7 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 358 | 5 | 1 | 7 | 2.6 | CCOC(=O)Cc1csc(NC(=O)c2cc(=O)c3ccccc3o2)n1 | nan | ||
CHEMBL1371941 | 34702 | 7 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 358 | 5 | 1 | 7 | 2.6 | CCOC(=O)Cc1csc(NC(=O)c2cc(=O)c3ccccc3o2)n1 | nan | ||
1218 | 10388 | 30 | None | -2691 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 289 | 1 | 3 | 3 | 3.0 | Oc1c(O)cc2c(c1Cl)CCNCC2c1ccccc1 | nan | ||
938 | 10388 | 30 | None | -2691 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 289 | 1 | 3 | 3 | 3.0 | Oc1c(O)cc2c(c1Cl)CCNCC2c1ccccc1 | nan | ||
CHEMBL353335 | 10388 | 30 | None | -2691 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 289 | 1 | 3 | 3 | 3.0 | Oc1c(O)cc2c(c1Cl)CCNCC2c1ccccc1 | nan | ||
3380750 | 115939 | 12 | None | 3 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 521 | 5 | 1 | 6 | 6.9 | CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)C1c1cn(Cc2ccc(Cl)cc2Cl)nc1-c1ccccc1 | nan | ||
CHEMBL3214406 | 115939 | 12 | None | 3 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 521 | 5 | 1 | 6 | 6.9 | CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)C1c1cn(Cc2ccc(Cl)cc2Cl)nc1-c1ccccc1 | nan | ||
53382850 | 86989 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 353 | 4 | 2 | 3 | 4.4 | Nc1nc2ccccc2cc1C(=O)NCc1ccc(-c2ccccc2)cc1 | nan | ||
CHEMBL2136916 | 86989 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 353 | 4 | 2 | 3 | 4.4 | Nc1nc2ccccc2cc1C(=O)NCc1ccc(-c2ccccc2)cc1 | nan | ||
51360281 | 86850 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 453 | 4 | 3 | 10 | 0.1 | CN(Cc1ccc2c(c1)CCCN2C)C(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | nan | ||
CHEMBL2130641 | 86850 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 453 | 4 | 3 | 10 | 0.1 | CN(Cc1ccc2c(c1)CCCN2C)C(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | nan | ||
2534340 | 40784 | 9 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 332 | 6 | 1 | 4 | 3.3 | O=C(COc1ccc(C(=O)c2ccccc2)cc1)Nc1cccnc1 | nan | ||
CHEMBL1424583 | 40784 | 9 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 332 | 6 | 1 | 4 | 3.3 | O=C(COc1ccc(C(=O)c2ccccc2)cc1)Nc1cccnc1 | nan | ||
663629 | 26388 | 7 | None | 100 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 296 | 2 | 1 | 4 | 3.4 | COc1cccc2[nH]c3c(N4CCCC(C)C4)ncnc3c12 | nan | ||
CHEMBL1300327 | 26388 | 7 | None | 100 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 296 | 2 | 1 | 4 | 3.4 | COc1cccc2[nH]c3c(N4CCCC(C)C4)ncnc3c12 | nan | ||
49795269 | 95358 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 412 | 6 | 3 | 7 | 3.4 | O=C(Nc1ccc(Oc2ccccc2)cc1)c1csc([C@H]2C[C@H](O)[C@@H](CO)O2)n1 | nan | ||
CHEMBL2355112 | 95358 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 412 | 6 | 3 | 7 | 3.4 | O=C(Nc1ccc(Oc2ccccc2)cc1)c1csc([C@H]2C[C@H](O)[C@@H](CO)O2)n1 | nan | ||
4525145 | 62412 | 5 | None | 16 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 3 | 0 | 3 | 5.5 | CC[n+]1c(/C=C2\SC(c3ccccc3C)=CN2C)sc2ccccc21 | nan | ||
6140197 | 62412 | 5 | None | 16 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 3 | 0 | 3 | 5.5 | CC[n+]1c(/C=C2\SC(c3ccccc3C)=CN2C)sc2ccccc21 | nan | ||
73945770 | 62412 | 5 | None | 16 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 3 | 0 | 3 | 5.5 | CC[n+]1c(/C=C2\SC(c3ccccc3C)=CN2C)sc2ccccc21 | nan | ||
CHEMBL1462215 | 62412 | 5 | None | 16 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 3 | 0 | 3 | 5.5 | CC[n+]1c(/C=C2\SC(c3ccccc3C)=CN2C)sc2ccccc21 | nan | ||
CHEMBL1621471 | 62412 | 5 | None | 16 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 3 | 0 | 3 | 5.5 | CC[n+]1c(/C=C2\SC(c3ccccc3C)=CN2C)sc2ccccc21 | nan | ||
24792082 | 61327 | 1 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 380 | 4 | 2 | 4 | 2.9 | CC(C)(C)c1ccc(-n2ncc3c2CCCC3NC(=O)C2(C(N)=O)CC2)cc1 | nan | ||
CHEMBL1610300 | 61327 | 1 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 380 | 4 | 2 | 4 | 2.9 | CC(C)(C)c1ccc(-n2ncc3c2CCCC3NC(=O)C2(C(N)=O)CC2)cc1 | nan | ||
16306739 | 42108 | 5 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 464 | 8 | 0 | 8 | 2.2 | COc1ccc(CN(C)c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])cc1OC | nan | ||
CHEMBL1437030 | 42108 | 5 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 464 | 8 | 0 | 8 | 2.2 | COc1ccc(CN(C)c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])cc1OC | nan | ||
4143977 | 66302 | 5 | None | 2 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 461 | 7 | 1 | 7 | 4.6 | COCC(C)n1c(-c2ccc3c(c2)NC(=O)CO3)cs/c1=N\c1ccc(OC(F)F)cc1 | nan | ||
CHEMBL1716038 | 66302 | 5 | None | 2 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 461 | 7 | 1 | 7 | 4.6 | COCC(C)n1c(-c2ccc3c(c2)NC(=O)CO3)cs/c1=N\c1ccc(OC(F)F)cc1 | nan | ||
2229408 | 62885 | 16 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 329 | 6 | 1 | 6 | 3.7 | COc1ccc(CCNc2ncnc3sc(C)cc23)cc1OC | nan | ||
CHEMBL1603001 | 62885 | 16 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 329 | 6 | 1 | 6 | 3.7 | COc1ccc(CCNc2ncnc3sc(C)cc23)cc1OC | nan | ||
CHEMBL1625429 | 62885 | 16 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 329 | 6 | 1 | 6 | 3.7 | COc1ccc(CCNc2ncnc3sc(C)cc23)cc1OC | nan | ||
24790916 | 37826 | 6 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 433 | 8 | 1 | 8 | 3.1 | CCOC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc(-c2ccc(O)nn2)s1 | nan | ||
CHEMBL1399389 | 37826 | 6 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 433 | 8 | 1 | 8 | 3.1 | CCOC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc(-c2ccc(O)nn2)s1 | nan | ||
24819837 | 34115 | 5 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 314 | 3 | 1 | 2 | 4.2 | O=C(Cc1ccc(Cl)cc1Cl)Nc1ccncc1Cl | nan | ||
CHEMBL1367597 | 34115 | 5 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 314 | 3 | 1 | 2 | 4.2 | O=C(Cc1ccc(Cl)cc1Cl)Nc1ccncc1Cl | nan | ||
24792017 | 38459 | 2 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 423 | 7 | 0 | 7 | 3.8 | CCOC(=O)CC1CCCCN1C(=O)c1cc(COc2cccc3cnccc23)on1 | nan | ||
CHEMBL1405288 | 38459 | 2 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 423 | 7 | 0 | 7 | 3.8 | CCOC(=O)CC1CCCCN1C(=O)c1cc(COc2cccc3cnccc23)on1 | nan | ||
24980848 | 48645 | 5 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 524 | 10 | 2 | 7 | 2.1 | CCN(CC)S(=O)(=O)c1cc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C | nan | ||
CHEMBL1493864 | 48645 | 5 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 524 | 10 | 2 | 7 | 2.1 | CCN(CC)S(=O)(=O)c1cc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C | nan | ||
2552706 | 39427 | 4 | None | 20 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 487 | 6 | 0 | 9 | 5.6 | O=c1cc(CSc2nnc(-c3cccs3)n2Cc2ccccc2)nc2sc3ccccc3n12 | nan | ||
CHEMBL1413056 | 39427 | 4 | None | 20 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 487 | 6 | 0 | 9 | 5.6 | O=c1cc(CSc2nnc(-c3cccs3)n2Cc2ccccc2)nc2sc3ccccc3n12 | nan | ||
386315 | 74092 | 1 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 583 | 7 | 1 | 14 | 1.8 | CC(=O)OCC1OC(n2c(S)c(C#N)c(-c3ccccc3)c(C#N)c2=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O | nan | ||
CHEMBL1884207 | 74092 | 1 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 583 | 7 | 1 | 14 | 1.8 | CC(=O)OCC1OC(n2c(S)c(C#N)c(-c3ccccc3)c(C#N)c2=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O | nan | ||
2311088 | 62424 | 4 | None | 1 | 3 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 387 | 3 | 0 | 2 | 5.2 | COc1ccc(-[n+]2c(-c3ccc(Cl)cc3)cn3c2CCc2ccccc2-3)cc1 | nan | ||
CHEMBL1457690 | 62424 | 4 | None | 1 | 3 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 387 | 3 | 0 | 2 | 5.2 | COc1ccc(-[n+]2c(-c3ccc(Cl)cc3)cn3c2CCc2ccccc2-3)cc1 | nan | ||
CHEMBL1621585 | 62424 | 4 | None | 1 | 3 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 387 | 3 | 0 | 2 | 5.2 | COc1ccc(-[n+]2c(-c3ccc(Cl)cc3)cn3c2CCc2ccccc2-3)cc1 | nan | ||
1245647 | 43119 | 14 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 404 | 5 | 2 | 3 | 5.0 | NC(=O)c1c(-c2ccc(Cl)cc2Cl)csc1NC(=O)Cc1ccccc1 | nan | ||
CHEMBL1446412 | 43119 | 14 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 404 | 5 | 2 | 3 | 5.0 | NC(=O)c1c(-c2ccc(Cl)cc2Cl)csc1NC(=O)Cc1ccccc1 | nan | ||
1400355 | 28621 | 9 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 377 | 7 | 3 | 4 | 2.8 | CCC(NCCC(c1ccccc1)c1ccccc1)=C1C(=O)NC(=O)NC1=O | nan | ||
CHEMBL1319737 | 28621 | 9 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 377 | 7 | 3 | 4 | 2.8 | CCC(NCCC(c1ccccc1)c1ccccc1)=C1C(=O)NC(=O)NC1=O | nan | ||
135411696 | 48684 | 10 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 389 | 4 | 1 | 6 | 4.3 | COc1c(/C=C2\SC(Nc3ccccc3Cl)=NC2=O)cccc1[N+](=O)[O-] | nan | ||
CHEMBL1494282 | 48684 | 10 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 389 | 4 | 1 | 6 | 4.3 | COc1c(/C=C2\SC(Nc3ccccc3Cl)=NC2=O)cccc1[N+](=O)[O-] | nan | ||
20231 | 39889 | 33 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 210 | 1 | 1 | 3 | 2.6 | Cc1nc(O)c(C#N)cc1-c1ccccc1 | nan | ||
CHEMBL1417067 | 39889 | 33 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 210 | 1 | 1 | 3 | 2.6 | Cc1nc(O)c(C#N)cc1-c1ccccc1 | nan | ||
309279 | 73980 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 456 | 4 | 0 | 7 | 5.1 | COc1ccc(C2=CC(c3ccc4c(c3)OCO4)c3c(c4ccccc4oc3=O)O2)cc1OC | nan | ||
CHEMBL1878306 | 73980 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 456 | 4 | 0 | 7 | 5.1 | COc1ccc(C2=CC(c3ccc4c(c3)OCO4)c3c(c4ccccc4oc3=O)O2)cc1OC | nan | ||
2240759 | 48209 | 14 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 326 | 6 | 1 | 4 | 2.6 | CCOc1cc(S(=O)(=O)NCc2ccncc2)ccc1Cl | nan | ||
CHEMBL1490503 | 48209 | 14 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 326 | 6 | 1 | 4 | 2.6 | CCOc1cc(S(=O)(=O)NCc2ccncc2)ccc1Cl | nan | ||
2464572 | 28819 | 6 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 460 | 10 | 0 | 7 | 4.5 | COCCn1c(SCCCC(=O)c2ccc(Br)cc2)nnc1-c1ccncc1 | nan | ||
CHEMBL1321513 | 28819 | 6 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 460 | 10 | 0 | 7 | 4.5 | COCCn1c(SCCCC(=O)c2ccc(Br)cc2)nnc1-c1ccncc1 | nan | ||
91754 | 92025 | 63 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 364 | 3 | 0 | 4 | 5.2 | CC(C)(C)c1ccc(CSc2cnn(C(C)(C)C)c(=O)c2Cl)cc1 | nan | ||
CHEMBL225963 | 92025 | 63 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 364 | 3 | 0 | 4 | 5.2 | CC(C)(C)c1ccc(CSc2cnn(C(C)(C)C)c(=O)c2Cl)cc1 | nan | ||
187 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
294 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
65 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
8593 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
CHEMBL667 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
DB03128 | 7043 | 39 | None | -22 | 8 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | nan | ||
261711 | 66334 | 3 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 2.7 | Cc1ccc(CCNc2ncnc(Cl)c2N)cc1 | nan | ||
CHEMBL1717339 | 66334 | 3 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 2.7 | Cc1ccc(CCNc2ncnc(Cl)c2N)cc1 | nan | ||
659242 | 36612 | 14 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 300 | 2 | 1 | 5 | 3.4 | CSc1nc(N)c(C#N)c(-c2ccccc2Cl)c1C#N | nan | ||
CHEMBL1387556 | 36612 | 14 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 300 | 2 | 1 | 5 | 3.4 | CSc1nc(N)c(C#N)c(-c2ccccc2Cl)c1C#N | nan | ||
1726 | 9275 | 13 | None | -933 | 8 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | nan | ||
1993 | 9275 | 13 | None | -933 | 8 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | nan | ||
7438 | 9275 | 13 | None | -933 | 8 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | nan | ||
CHEMBL978 | 9275 | 13 | None | -933 | 8 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | nan | ||
DB06709 | 9275 | 13 | None | -933 | 8 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | nan | ||
2421595 | 35310 | 6 | None | 26 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 417 | 7 | 0 | 7 | 3.9 | COc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3cnc4ccccc43)c2C)cc1 | nan | ||
CHEMBL1376266 | 35310 | 6 | None | 26 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 417 | 7 | 0 | 7 | 3.9 | COc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3cnc4ccccc43)c2C)cc1 | nan | ||
4295603 | 35774 | 6 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 561 | 6 | 1 | 6 | 3.5 | CC1(C)CC2CC(C)(CN2S(=O)(=O)c2ccc(C(=O)Nc3cccc(S(=O)(=O)N4CCOCC4)c3)cc2)C1 | nan | ||
CHEMBL1380444 | 35774 | 6 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 561 | 6 | 1 | 6 | 3.5 | CC1(C)CC2CC(C)(CN2S(=O)(=O)c2ccc(C(=O)Nc3cccc(S(=O)(=O)N4CCOCC4)c3)cc2)C1 | nan | ||
4573346 | 46764 | 13 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 281 | 3 | 2 | 4 | 2.6 | Cn1c(C(=O)NN)cc2cc(Oc3ccccc3)ccc21 | nan | ||
CHEMBL1478533 | 46764 | 13 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 281 | 3 | 2 | 4 | 2.6 | Cn1c(C(=O)NN)cc2cc(Oc3ccccc3)ccc21 | nan | ||
730925 | 43552 | 10 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 278 | 3 | 1 | 4 | 3.7 | N#Cc1cc(-c2ccccc2)oc1NC(=O)c1ccco1 | nan | ||
CHEMBL1449874 | 43552 | 10 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 278 | 3 | 1 | 4 | 3.7 | N#Cc1cc(-c2ccccc2)oc1NC(=O)c1ccco1 | nan | ||
659248 | 201151 | 10 | None | 1 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 258 | 5 | 1 | 2 | 3.5 | CCCCCCn1c2c(c(=N)c3c1CCC3)CCC2 | nan | ||
CHEMBL528708 | 201151 | 10 | None | 1 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 258 | 5 | 1 | 2 | 3.5 | CCCCCCn1c2c(c(=N)c3c1CCC3)CCC2 | nan | ||
CHEMBL530291 | 201151 | 10 | None | 1 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 258 | 5 | 1 | 2 | 3.5 | CCCCCCn1c2c(c(=N)c3c1CCC3)CCC2 | nan | ||
53299527 | 86969 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 400 | 3 | 0 | 3 | 5.9 | Cc1cc(Br)cn2c(Cc3cccc(Cl)c3)c(-c3ccco3)nc12 | nan | ||
CHEMBL2136078 | 86969 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 400 | 3 | 0 | 3 | 5.9 | Cc1cc(Br)cn2c(Cc3cccc(Cl)c3)c(-c3ccco3)nc12 | nan | ||
2967368 | 40588 | 12 | None | 72 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 380 | 5 | 1 | 7 | 3.3 | O=C(CSc1nnnn1C1CC2CCC1C2)Nc1ccnc2ccccc12 | nan | ||
CHEMBL1423004 | 40588 | 12 | None | 72 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 380 | 5 | 1 | 7 | 3.3 | O=C(CSc1nnnn1C1CC2CCC1C2)Nc1ccnc2ccccc12 | nan | ||
934786 | 47833 | 11 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 324 | 4 | 1 | 5 | 3.4 | Cc1cc(C)nc(SCC(=O)Nc2ccnc3ccccc23)n1 | nan | ||
CHEMBL1487720 | 47833 | 11 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 324 | 4 | 1 | 5 | 3.4 | Cc1cc(C)nc(SCC(=O)Nc2ccnc3ccccc23)n1 | nan | ||
24817872 | 39380 | 6 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 363 | 4 | 1 | 5 | 3.5 | CCn1cc(C(=O)NC2CCCc3c2cnn3-c2cccc(C)c2C)cn1 | nan | ||
CHEMBL1412747 | 39380 | 6 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 363 | 4 | 1 | 5 | 3.5 | CCn1cc(C(=O)NC2CCCc3c2cnn3-c2cccc(C)c2C)cn1 | nan | ||
649098 | 55428 | 6 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 380 | 7 | 0 | 8 | 3.5 | COc1ccc(C(=O)CSc2nnc(Cn3cnc4ccccc43)o2)cc1 | nan | ||
CHEMBL1557584 | 55428 | 6 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 380 | 7 | 0 | 8 | 3.5 | COc1ccc(C(=O)CSc2nnc(Cn3cnc4ccccc43)o2)cc1 | nan | ||
33572 | 211980 | 8 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 287 | 6 | 4 | 4 | 2.4 | C[C@H](NCCc1ccc(O)cc1)[C@H](O)c1ccc(O)cc1 | nan | ||
CHEMBL1201160 | 211980 | 8 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 287 | 6 | 4 | 4 | 2.4 | C[C@H](NCCc1ccc(O)cc1)[C@H](O)c1ccc(O)cc1 | nan | ||
CHEMBL785 | 211980 | 8 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 287 | 6 | 4 | 4 | 2.4 | C[C@H](NCCc1ccc(O)cc1)[C@H](O)c1ccc(O)cc1 | nan | ||
4412278 | 54059 | 6 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 561 | 6 | 1 | 6 | 3.5 | CC1(C)CC2CC(C)(CN2S(=O)(=O)c2ccc(C(=O)Nc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc2)C1 | nan | ||
CHEMBL1544054 | 54059 | 6 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 561 | 6 | 1 | 6 | 3.5 | CC1(C)CC2CC(C)(CN2S(=O)(=O)c2ccc(C(=O)Nc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc2)C1 | nan | ||
1740950 | 39594 | 7 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 469 | 5 | 1 | 6 | 6.3 | Cc1ccccc1-c1cc(C(=O)Nc2sc(C(=O)OC(C)C)c(C)c2C#N)c2ccccc2n1 | nan | ||
CHEMBL1414465 | 39594 | 7 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 469 | 5 | 1 | 6 | 6.3 | Cc1ccccc1-c1cc(C(=O)Nc2sc(C(=O)OC(C)C)c(C)c2C#N)c2ccccc2n1 | nan | ||
2811624 | 52844 | 5 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 347 | 3 | 1 | 5 | 2.7 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1cc(F)cc2c1OCOC2 | nan | ||
CHEMBL1533321 | 52844 | 5 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 347 | 3 | 1 | 5 | 2.7 | Cn1nc(C(C)(C)C)cc1C(=O)NCc1cc(F)cc2c1OCOC2 | nan | ||
2204911 | 37796 | 9 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 360 | 7 | 1 | 3 | 3.7 | CCCCc1ccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 | nan | ||
CHEMBL1399125 | 37796 | 9 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 360 | 7 | 1 | 3 | 3.7 | CCCCc1ccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 | nan | ||
11417 | 10420 | 0 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 24517231 | ||||
16133243 | 8497 | 0 | None | -851 | 5 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 | ||||
3593 | 8497 | 0 | None | -851 | 5 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 | ||||
101927062 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
155817445 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
16133823 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
3592 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
44584852 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
6090 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
91898917 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
CHEMBL506553 | 8495 | 22 | None | -1174 | 5 | Human | 7.1 | pIC50 | = | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
155817484 | 8496 | 0 | None | -186 | 5 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
6117 | 8496 | 0 | None | -186 | 5 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
6129 | 8496 | 0 | None | -186 | 5 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 9832121 | ||||
3594 | 8523 | 0 | None | 2 | 3 | Human | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 15944009 | ||||
3596 | 8524 | 0 | None | 29 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 | ||||
131863305 | 7115 | 0 | None | 1 | 3 | Rat | 6.0 | pIC50 | > | 6 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 | ||||
155817486 | 7115 | 0 | None | 1 | 3 | Rat | 6.0 | pIC50 | > | 6 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 | ||||
6123 | 7115 | 0 | None | 1 | 3 | Rat | 6.0 | pIC50 | > | 6 | Functional | Guide to Pharmacology | None | None | None | None | 20880399 |
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 |
CHEMBL503473 | 220946 | 14 | None | -478 | 3 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O | 10.1021/jm801088x | |||||
16132180 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
16133822 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
6087 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
CHEMBL499980 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
CHEMBL526003 | 222448 | 29 | None | -416 | 3 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(N)=O | 10.1021/jm801088x | |||||
155817464 | 8281 | 0 | None | -173 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
3866 | 8281 | 0 | None | -173 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
44587986 | 8281 | 0 | None | -173 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
91934870 | 8281 | 0 | None | -173 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
CHEMBL499179 | 8281 | 0 | None | -173 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm801088x | |||||
44414120 | 86630 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1ccccc1N1C(=O)/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc21 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL212224 | 86630 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1ccccc1N1C(=O)/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc21 | 10.1016/j.bmcl.2006.05.025 | |||
11677898 | 146034 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)CC(O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL378991 | 146034 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)CC(O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
3561805 | 86759 | 15 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 330 | 3 | 0 | 2 | 4.6 | C=CCN1C(=O)/C(=N/c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1021/jm060001n | |||
CHEMBL212729 | 86759 | 15 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 330 | 3 | 0 | 2 | 4.6 | C=CCN1C(=O)/C(=N/c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1021/jm060001n | |||
1471834 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1021/jm060001n | |||
6126 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1021/jm060001n | |||
CHEMBL210288 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1021/jm060001n | |||
1471834 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
6126 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL210288 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
44414299 | 146003 | 0 | None | 19 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 495 | 9 | 0 | 4 | 6.6 | CCN(CC)CCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL378825 | 146003 | 0 | None | 19 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 495 | 9 | 0 | 4 | 6.6 | CCN(CC)CCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
44414138 | 86299 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 453 | 6 | 0 | 4 | 5.4 | CN(C)CCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL211398 | 86299 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 453 | 6 | 0 | 4 | 5.4 | CN(C)CCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
44414234 | 84728 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)C[C@H](O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209642 | 84728 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)C[C@H](O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
44414075 | 145248 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 467 | 7 | 0 | 4 | 5.8 | CN(C)CCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL377468 | 145248 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 467 | 7 | 0 | 4 | 5.8 | CN(C)CCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
44414225 | 86442 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)C[C@@H](O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL211522 | 86442 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 511 | 9 | 1 | 5 | 5.6 | CCN(CC)C[C@@H](O)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
11540517 | 87036 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 495 | 9 | 0 | 4 | 6.6 | CCN(CC)CCCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL213893 | 87036 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 495 | 9 | 0 | 4 | 6.6 | CCN(CC)CCCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
44414235 | 148173 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 467 | 7 | 0 | 4 | 6.2 | CCN(CC)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL383941 | 148173 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 467 | 7 | 0 | 4 | 6.2 | CCN(CC)COc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
135559217 | 146014 | 3 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 290 | 1 | 1 | 2 | 4.1 | O=C1Nc2ccccc2/C1=N\c1cccc(Cl)c1Cl | 10.1021/jm060001n | |||
CHEMBL378877 | 146014 | 3 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 290 | 1 | 1 | 2 | 4.1 | O=C1Nc2ccccc2/C1=N\c1cccc(Cl)c1Cl | 10.1021/jm060001n | |||
44414058 | 84698 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 7.0 | CCN(CC)CCCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209476 | 84698 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 7.0 | CCN(CC)CCCCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
44414043 | 85149 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 7 | 0 | 4 | 6.4 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1cccc(OCCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL211031 | 85149 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 7 | 0 | 4 | 6.4 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1cccc(OCCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.05.025 | |||
11698643 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
6125 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209497 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 10.1016/j.bmcl.2006.05.025 | |||
44412817 | 85233 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 360 | 4 | 0 | 2 | 5.4 | CCC(CC)N1C(=O)/C(=N/c2ccc(C(F)(F)F)cc2)c2ccccc21 | 10.1021/jm060001n | |||
CHEMBL211169 | 85233 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 360 | 4 | 0 | 2 | 5.4 | CCC(CC)N1C(=O)/C(=N/c2ccc(C(F)(F)F)cc2)c2ccccc21 | 10.1021/jm060001n | |||
135411930 | 84701 | 19 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 290 | 1 | 1 | 2 | 3.8 | O=C1Nc2ccccc2/C1=N\c1cccc(C(F)(F)F)c1 | 10.1021/jm060001n | |||
CHEMBL209480 | 84701 | 19 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 290 | 1 | 1 | 2 | 3.8 | O=C1Nc2ccccc2/C1=N\c1cccc(C(F)(F)F)c1 | 10.1021/jm060001n | |||
44414180 | 145182 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 7.0 | CCN(CC)CCCCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL377328 | 145182 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 10 | 0 | 4 | 7.0 | CCN(CC)CCCCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
11677377 | 86383 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL211467 | 86383 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
44414137 | 172753 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 6 | 0 | 4 | 6.0 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1ccccc1OCCN1CCCC1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL425250 | 172753 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 6 | 0 | 4 | 6.0 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1ccccc1OCCN1CCCC1 | 10.1016/j.bmcl.2006.05.025 | |||
11712935 | 84704 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 493 | 6 | 0 | 4 | 6.4 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209498 | 84704 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 493 | 6 | 0 | 4 | 6.4 | O=C1/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc2N1c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.05.025 | |||
135411931 | 84778 | 38 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 256 | 1 | 1 | 2 | 3.4 | O=C1Nc2ccccc2/C1=N\c1ccc(Cl)cc1 | 10.1021/jm060001n | |||
CHEMBL209737 | 84778 | 38 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 256 | 1 | 1 | 2 | 3.4 | O=C1Nc2ccccc2/C1=N\c1ccc(Cl)cc1 | 10.1021/jm060001n | |||
44414042 | 84702 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209481 | 84702 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 8 | 0 | 4 | 6.2 | CCN(CC)CCOc1cccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)c1 | 10.1016/j.bmcl.2006.05.025 | |||
11544426 | 148762 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 328 | 2 | 0 | 2 | 3.8 | C#CCN1C(=O)/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc21 | 10.1021/jm060001n | |||
CHEMBL387401 | 148762 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 328 | 2 | 0 | 2 | 3.8 | C#CCN1C(=O)/C(=N/c2cccc(C(F)(F)F)c2)c2ccccc21 | 10.1021/jm060001n | |||
11698159 | 84776 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 453 | 6 | 0 | 4 | 5.4 | CN(C)CCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
CHEMBL209730 | 84776 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 453 | 6 | 0 | 4 | 5.4 | CN(C)CCOc1ccc(N2C(=O)/C(=N/c3cccc(C(F)(F)F)c3)c3ccccc32)cc1 | 10.1016/j.bmcl.2006.05.025 | |||
155817484 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817484 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6117 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6117 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6129 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6129 | 8496 | 0 | None | -22 | 6 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817484 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817484 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6117 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6117 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6129 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6129 | 8496 | 0 | None | -10 | 6 | Rat | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6074 | 9220 | 0 | None | -301 | 3 | Human | 5.0 | pKd | > | 5 | Binding | Guide to Pharmacology | None | None | None | None | 23192661 | |||||
None | 222840 | 0 | 125I-GALANIN | -27 | 6 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 418 | 8 | 0 | 4 | 4.3 | CC1=CC=C(C=C1)OCCN(C2=CC=CC=C2OC)C(=O)CN3CCCCC3.Cl | None | |||
None | 222841 | 0 | 125I-p Galanin | - | 1 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | None | None | None | None | None | |||||
None | 222840 | 0 | 125I-GALANIN | -37 | 6 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 418 | 8 | 0 | 4 | 4.3 | CC1=CC=C(C=C1)OCCN(C2=CC=CC=C2OC)C(=O)CN3CCCCC3.Cl | None | |||
None | 222840 | 0 | 125I-p Galanin | -27 | 6 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 418 | 8 | 0 | 4 | 4.3 | CC1=CC=C(C=C1)OCCN(C2=CC=CC=C2OC)C(=O)CN3CCCCC3.Cl | None | |||
6102 | 9217 | 0 | None | -30 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | None | None | None | None | 21333705 | |||||
6103 | 9218 | 0 | None | -18 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | Guide to Pharmacology | None | None | None | None | 21333705 | |||||
6101 | 9216 | 0 | None | -75 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | None | None | None | None | 19467704 | |||||
16132180 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16132180 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
16133822 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133822 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6087 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6087 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
CHEMBL499980 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
CHEMBL499980 | 8505 | 21 | None | -208 | 8 | Human | 6.5 | pKi | = | 6.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817474 | 8509 | 0 | None | -16 | 5 | Rat | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | None | None | None | None | 15944007 | |||||
5357 | 8509 | 0 | None | -16 | 5 | Rat | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | None | None | None | None | 15944007 | |||||
6104 | 9219 | 0 | None | -45 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | None | None | None | None | 21333705 | |||||
155817474 | 8509 | 0 | None | -12 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | None | None | None | None | 19467704 | |||||
5357 | 8509 | 0 | None | -12 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | None | None | None | None | 19467704 | |||||
3899 | 9225 | 0 | None | -933 | 8 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3899 | 9225 | 0 | None | -933 | 8 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6075 | 8889 | 0 | None | -5 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | Guide to Pharmacology | None | None | None | None | 23600864 | |||||
101927062 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
101927062 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817445 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817445 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
16133823 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133823 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
3592 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3592 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
44584852 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
44584852 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6090 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6090 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
91898917 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
91898917 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
CHEMBL506553 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
CHEMBL506553 | 8495 | 22 | None | -239 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
16132180 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
16132180 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16132180 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
16133822 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
16133822 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133822 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
6087 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6087 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6087 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
CHEMBL499980 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
CHEMBL499980 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
CHEMBL499980 | 8505 | 21 | None | -44 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
3899 | 9225 | 0 | None | -501 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 15944002 | |||||
3899 | 9225 | 0 | None | -501 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3899 | 9225 | 0 | None | -501 | 8 | Rat | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817487 | 8510 | 0 | None | -20 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6130 | 8510 | 0 | None | -20 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
101927062 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817445 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133823 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3592 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
44584852 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6090 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
91898917 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
CHEMBL506553 | 8495 | 22 | None | -181 | 6 | Rat | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6100 | 9227 | 0 | None | -213 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | None | |||||
3896 | 9221 | 0 | None | -380 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3896 | 9221 | 0 | None | -380 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817479 | 8517 | 0 | None | -14 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817479 | 8517 | 0 | None | -14 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6083 | 8517 | 0 | None | -14 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6083 | 8517 | 0 | None | -14 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817479 | 8517 | 0 | None | -12 | 6 | Rat | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6083 | 8517 | 0 | None | -12 | 6 | Rat | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3896 | 9221 | 0 | None | -281 | 7 | Rat | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 15944002 | |||||
3896 | 9221 | 0 | None | -281 | 7 | Rat | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3896 | 9221 | 0 | None | -281 | 7 | Rat | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6146 | 7125 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6127 | 8542 | 0 | None | 575 | 3 | Rat | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 397 | 3 | 0 | 4 | 5.2 | COc1ccc(cn1)N1C(=O)/C(=N/c2ccc(c(c2)Cl)Cl)/c2c1cccc2 | 15944002 | |||
9800980 | 8542 | 0 | None | 575 | 3 | Rat | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 397 | 3 | 0 | 4 | 5.2 | COc1ccc(cn1)N1C(=O)/C(=N/c2ccc(c(c2)Cl)Cl)/c2c1cccc2 | 15944002 | |||
1471834 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16287967 | |||
1471834 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16730981 | |||
1471834 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16789730 | |||
6126 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16287967 | |||
6126 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16730981 | |||
6126 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16789730 | |||
CHEMBL210288 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16287967 | |||
CHEMBL210288 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16730981 | |||
CHEMBL210288 | 10401 | 42 | None | 4 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 366 | 2 | 0 | 2 | 5.5 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1ccccc1)cccc2 | 16789730 | |||
3898 | 9224 | 0 | None | -63 | 7 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3898 | 9224 | 0 | None | -63 | 7 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6076 | 8890 | 0 | None | -2 | 3 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 23600864 | |||||
155817465 | 8511 | 0 | None | -13 | 6 | Rat | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817465 | 8511 | 0 | None | -13 | 6 | Rat | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
3876 | 8511 | 0 | None | -13 | 6 | Rat | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3876 | 8511 | 0 | None | -13 | 6 | Rat | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
155817484 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817484 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6117 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6117 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6129 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6129 | 8496 | 0 | None | -22 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817463 | 7564 | 0 | None | -34 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817463 | 7564 | 0 | None | -34 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
3861 | 7564 | 0 | None | -34 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3861 | 7564 | 0 | None | -34 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
16133243 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 19467704 | |||||
16133243 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 21333705 | |||||
16133243 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133243 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
3593 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 19467704 | |||||
3593 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 21333705 | |||||
3593 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3593 | 8497 | 0 | None | -51 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817484 | 8496 | 0 | None | -10 | 6 | Rat | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6117 | 8496 | 0 | None | -10 | 6 | Rat | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6129 | 8496 | 0 | None | -10 | 6 | Rat | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6139 | 8507 | 0 | None | -1 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3897 | 9223 | 0 | None | -27 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3897 | 9223 | 0 | None | -27 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
11698643 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16287967 | |||
11698643 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16730981 | |||
11698643 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16789730 | |||
6125 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16287967 | |||
6125 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16730981 | |||
6125 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16789730 | |||
CHEMBL209497 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16287967 | |||
CHEMBL209497 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16730981 | |||
CHEMBL209497 | 10402 | 11 | None | 15 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 479 | 6 | 0 | 4 | 6.0 | O=C1C(=Nc2cccc(c2)C(F)(F)F)c2c(N1c1cccc(c1)OCCN1CCCC1)cccc2 | 16789730 | |||
3898 | 9224 | 0 | None | -16 | 7 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | None | None | None | None | 15944002 | |||||
3898 | 9224 | 0 | None | -16 | 7 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3898 | 9224 | 0 | None | -16 | 7 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133243 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 15944002 | |||||
16133243 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
16133243 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
16133243 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
3593 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 15944002 | |||||
3593 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3593 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3593 | 8497 | 0 | None | -22 | 8 | Rat | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
155817463 | 7564 | 0 | None | -7 | 8 | Rat | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817463 | 7564 | 0 | None | -7 | 8 | Rat | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3861 | 7564 | 0 | None | -7 | 8 | Rat | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
3861 | 7564 | 0 | None | -7 | 8 | Rat | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
3897 | 9223 | 0 | None | -5 | 6 | Rat | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6074 | 9220 | 0 | None | -301 | 3 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | None | None | None | None | 23192661 | |||||
3900 | 9229 | 0 | None | -758 | 3 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | None | None | None | None | None | |||||
6133 | 8276 | 0 | None | 1 | 2 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817483 | 8498 | 0 | None | 1 | 2 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6094 | 8498 | 0 | None | 1 | 2 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817480 | 8512 | 0 | None | -1 | 6 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817480 | 8512 | 0 | None | -1 | 6 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
155817480 | 8512 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6091 | 8512 | 0 | None | -1 | 6 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6091 | 8512 | 0 | None | -1 | 6 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 | |||||
6091 | 8512 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
155817481 | 8513 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
155817481 | 8513 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
6092 | 8513 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9405385 | |||||
6092 | 8513 | 0 | None | -1 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9742938 | |||||
6095 | 8520 | 0 | None | -72 | 6 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6095 | 8520 | 0 | None | -72 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9722565 | |||||
6095 | 8520 | 0 | None | -72 | 6 | Rat | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | None | None | None | None | 9880084 |