Ligand source activities (1 row/activity)
Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Potency) |
# tested GPCRs (Potency) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
56839344 | 151519 | 0 | None | 10 | 8 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
CHEMBL3967284 | 151519 | 0 | None | 10 | 8 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
118517359 | 143863 | 0 | None | -213 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 456 | 8 | 2 | 3 | 4.8 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Br)c2)cc1 | nan | ||
CHEMBL3906016 | 143863 | 0 | None | -213 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 456 | 8 | 2 | 3 | 4.8 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Br)c2)cc1 | nan | ||
118517359 | 143863 | 0 | None | -213 | 4 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 456 | 8 | 2 | 3 | 4.8 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Br)c2)cc1 | nan | ||
CHEMBL3906016 | 143863 | 0 | None | -213 | 4 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 456 | 8 | 2 | 3 | 4.8 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Br)c2)cc1 | nan | ||
11955193 | 143052 | 0 | None | -10 | 3 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 2 | 2 | 5.3 | CC(C)(C)c1ccc([C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)O)cc1 | nan | ||
CHEMBL3899346 | 143052 | 0 | None | -10 | 3 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 2 | 2 | 5.3 | CC(C)(C)c1ccc([C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)O)cc1 | nan | ||
1884 | 3034 | 46 | None | -239 | 9 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5280363 | 3034 | 46 | None | -239 | 9 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
912 | 3034 | 46 | None | -239 | 9 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL815 | 3034 | 46 | None | -239 | 9 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
DB12789 | 3034 | 46 | None | -239 | 9 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
11955293 | 149309 | 0 | None | 1 | 2 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 394 | 8 | 2 | 4 | 4.3 | COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3O)[C@H](O)C[C@H]1Cl | nan | ||
CHEMBL3948932 | 149309 | 0 | None | 1 | 2 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 394 | 8 | 2 | 4 | 4.3 | COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3O)[C@H](O)C[C@H]1Cl | nan | ||
11955358 | 152548 | 0 | None | 1 | 3 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 364 | 8 | 2 | 2 | 4.7 | O=C(O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3)[C@H](O)C[C@H]1Cl | nan | ||
CHEMBL3976116 | 152548 | 0 | None | 1 | 3 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 364 | 8 | 2 | 2 | 4.7 | O=C(O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3)[C@H](O)C[C@H]1Cl | nan | ||
9825293 | 99593 | 8 | None | -83 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL287080 | 99593 | 8 | None | -83 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
118517361 | 152836 | 0 | None | -123 | 3 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 446 | 8 | 2 | 3 | 5.1 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(C(F)(F)F)c2)cc1 | nan | ||
CHEMBL3978590 | 152836 | 0 | None | -123 | 3 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 446 | 8 | 2 | 3 | 5.1 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(C(F)(F)F)c2)cc1 | nan | ||
6441607 | 154540 | 21 | None | 1 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL40183 | 154540 | 21 | None | 1 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
1894 | 943 | 35 | None | -891 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5311053 | 943 | 35 | None | -891 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL37853 | 943 | 35 | None | -891 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
DB11507 | 943 | 35 | None | -891 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
118517490 | 152621 | 0 | None | -977 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 414 | 8 | 2 | 3 | 4.4 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2ccc(F)c(F)c2)cc1 | nan | ||
CHEMBL3976710 | 152621 | 0 | None | -977 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 414 | 8 | 2 | 3 | 4.4 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2ccc(F)c(F)c2)cc1 | nan | ||
11955294 | 144235 | 0 | None | -1 | 2 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 380 | 8 | 3 | 3 | 4.2 | O=C(O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3O)[C@H](O)C[C@H]1Cl | nan | ||
CHEMBL3909111 | 144235 | 0 | None | -1 | 2 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 380 | 8 | 3 | 3 | 4.2 | O=C(O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3O)[C@H](O)C[C@H]1Cl | nan | ||
5311239 | 130096 | 22 | None | -30 | 3 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL36817 | 130096 | 22 | None | -30 | 3 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
11955384 | 147005 | 0 | None | -41 | 3 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 360 | 8 | 2 | 3 | 4.4 | CC(C)(C)c1ccc([C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)cc1 | nan | ||
CHEMBL3930718 | 147005 | 0 | None | -41 | 3 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 360 | 8 | 2 | 3 | 4.4 | CC(C)(C)c1ccc([C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)cc1 | nan | ||
118517360 | 143443 | 0 | None | -2398 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 412 | 8 | 2 | 3 | 4.7 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Cl)c2)cc1 | nan | ||
CHEMBL3902700 | 143443 | 0 | None | -2398 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 412 | 8 | 2 | 3 | 4.7 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Cl)c2)cc1 | nan | ||
11955357 | 148096 | 0 | None | 26 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 378 | 8 | 1 | 3 | 4.8 | COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3)[C@H](O)C[C@H]1Cl | nan | ||
CHEMBL3939358 | 148096 | 0 | None | 26 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 378 | 8 | 1 | 3 | 4.8 | COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc3c(c2)CCC3)[C@H](O)C[C@H]1Cl | nan | ||
118517485 | 142218 | 0 | None | -2041 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 396 | 8 | 2 | 3 | 4.2 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2ccc(F)cc2)cc1 | nan | ||
CHEMBL3892492 | 142218 | 0 | None | -2041 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 396 | 8 | 2 | 3 | 4.2 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2ccc(F)cc2)cc1 | nan | ||
92135977 | 152363 | 0 | None | -36307 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 396 | 8 | 2 | 3 | 4.2 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(F)c2)cc1 | nan | ||
CHEMBL3974652 | 152363 | 0 | None | -36307 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 396 | 8 | 2 | 3 | 4.2 | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(F)c2)cc1 | nan | ||
1955 | 16 | 1 | None | -3235 | 5 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5311240 | 16 | 1 | None | -3235 | 5 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL36041 | 16 | 1 | None | -3235 | 5 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
58681361 | 144148 | 0 | None | 19 | 3 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 318 | 8 | 2 | 3 | 3.5 | Cc1ccc([C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)cc1 | nan | ||
CHEMBL3908432 | 144148 | 0 | None | 19 | 3 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 318 | 8 | 2 | 3 | 3.5 | Cc1ccc([C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)cc1 | nan | ||
117630978 | 115370 | 0 | None | - | 1 | Human | 10.8 | pIC50 | = | 10.8 | Functional | ChEMBL | 535 | 6 | 2 | 4 | 5.9 | Cc1cccc(C)c1C1=C(O)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
CHEMBL3354618 | 115370 | 0 | None | - | 1 | Human | 10.8 | pIC50 | = | 10.8 | Functional | ChEMBL | 535 | 6 | 2 | 4 | 5.9 | Cc1cccc(C)c1C1=C(O)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
117631354 | 115368 | 0 | None | - | 1 | Human | 10.3 | pIC50 | = | 10.3 | Functional | ChEMBL | 537 | 7 | 2 | 5 | 5.3 | COc1ccc(C2=C(O)CC(Cc3cccc4c3CCC(NS(=O)(=O)c3ccc(Cl)cc3)C4)C2=O)cc1 | 10.1021/ml5002085 | ||
CHEMBL3354616 | 115368 | 0 | None | - | 1 | Human | 10.3 | pIC50 | = | 10.3 | Functional | ChEMBL | 537 | 7 | 2 | 5 | 5.3 | COc1ccc(C2=C(O)CC(Cc3cccc4c3CCC(NS(=O)(=O)c3ccc(Cl)cc3)C4)C2=O)cc1 | 10.1021/ml5002085 | ||
131116 | 14574 | 2 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.1 | CC(C)c1ccc2c(CCCCNS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1206329 | 14574 | 2 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.1 | CC(C)c1ccc2c(CCCCNS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL262655 | 14574 | 2 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.1 | CC(C)c1ccc2c(CCCCNS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
118714499 | 114008 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 379 | 5 | 2 | 3 | 2.8 | O=C(O)Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
CHEMBL3335473 | 114008 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 379 | 5 | 2 | 3 | 2.8 | O=C(O)Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
15745527 | 201258 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 385 | 7 | 4 | 4 | 3.4 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62937 | 201258 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 385 | 7 | 4 | 4 | 3.4 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
10764618 | 82839 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 420 | 10 | 3 | 5 | 3.2 | CN(C)CC/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21874 | 82839 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 420 | 10 | 3 | 5 | 3.2 | CN(C)CC/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44387221 | 129568 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 326 | 11 | 1 | 3 | 4.5 | CCCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL367721 | 129568 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 326 | 11 | 1 | 3 | 4.5 | CCCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44385988 | 128497 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 370 | 13 | 2 | 4 | 4.3 | CCCCC(O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL366990 | 128497 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 370 | 13 | 2 | 4 | 4.3 | CCCCC(O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44353269 | 19849 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1cccnn1 | 10.1021/jm960341g | ||
CHEMBL130365 | 19849 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1cccnn1 | 10.1021/jm960341g | ||
18921506 | 14493 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.9 | O=C(O)c1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205657 | 14493 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.9 | O=C(O)c1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130045 | 14493 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.9 | O=C(O)c1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
16757078 | 92180 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
CHEMBL243553 | 92180 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
71740443 | 90917 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402428 | 90917 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
15290037 | 14639 | 0 | None | -79 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207044 | 14639 | 0 | None | -79 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL341221 | 14639 | 0 | None | -79 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740563 | 90925 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402436 | 90925 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740562 | 90924 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402435 | 90924 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71456310 | 79301 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)C[S@+]([O-])[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL2115518 | 79301 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)C[S@+]([O-])[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
71740181 | 90912 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402423 | 90912 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
16757178 | 92887 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 441 | 5 | 2 | 6 | 4.1 | Cc1cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)ccc1Cl | 10.1021/jm070427h | ||
CHEMBL245262 | 92887 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 441 | 5 | 2 | 6 | 4.1 | Cc1cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)ccc1Cl | 10.1021/jm070427h | ||
16757487 | 92815 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 451 | 8 | 2 | 7 | 4.0 | CCCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL244819 | 92815 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 451 | 8 | 2 | 7 | 4.0 | CCCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
6449876 | 98736 | 18 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL281398 | 98736 | 18 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
117631017 | 115365 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 445 | 5 | 2 | 4 | 4.1 | CC1=C(O)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
CHEMBL3354613 | 115365 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 445 | 5 | 2 | 4 | 4.1 | CC1=C(O)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
10601327 | 79659 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 496 | 9 | 3 | 4 | 5.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(N/C(=N\C2CCCC2)NC(=O)c2ccccc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21303 | 79659 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 496 | 9 | 3 | 4 | 5.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(N/C(=N\C2CCCC2)NC(=O)c2ccccc2)c1 | 10.1021/jm9707941 | ||
16757488 | 92853 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 437 | 7 | 2 | 7 | 3.6 | CCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL245037 | 92853 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 437 | 7 | 2 | 7 | 3.6 | CCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
15018454 | 98980 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 369 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL282931 | 98980 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 369 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44386321 | 60130 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 366 | 12 | 1 | 3 | 5.5 | CCC/C=C(\C)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL175285 | 60130 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 366 | 12 | 1 | 3 | 5.5 | CCC/C=C(\C)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
10762387 | 19678 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL130236 | 19678 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
10067523 | 19280 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1cnccn1 | 10.1021/jm960341g | ||
CHEMBL129867 | 19280 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1cnccn1 | 10.1021/jm960341g | ||
16757178 | 92887 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 441 | 5 | 2 | 6 | 4.1 | Cc1cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)ccc1Cl | 10.1021/jm070427h | ||
CHEMBL245262 | 92887 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 441 | 5 | 2 | 6 | 4.1 | Cc1cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)ccc1Cl | 10.1021/jm070427h | ||
118711723 | 113515 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 391 | 6 | 2 | 4 | 3.4 | O=C1CC(c2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C=C1O | 10.1016/j.bmcl.2014.07.047 | ||
CHEMBL3326603 | 113515 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 391 | 6 | 2 | 4 | 3.4 | O=C1CC(c2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C=C1O | 10.1016/j.bmcl.2014.07.047 | ||
1976 | 3910 | 12 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 10.1016/S0960-894X(01)80103-7 | ||
6918030 | 3910 | 12 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL65030 | 3910 | 12 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 10.1016/S0960-894X(01)80103-7 | ||
15290037 | 14639 | 0 | None | 79 | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207044 | 14639 | 0 | None | 79 | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL341221 | 14639 | 0 | None | 79 | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 345 | 6 | 2 | 3 | 2.0 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
16757078 | 92180 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
CHEMBL243553 | 92180 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
10619606 | 98596 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 7 | 2 | 4 | 3.4 | CN(C)/C(=N/c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NC#N | 10.1021/jm9707941 | ||
CHEMBL280380 | 98596 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 7 | 2 | 4 | 3.4 | CN(C)/C(=N/c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NC#N | 10.1021/jm9707941 | ||
44353310 | 14496 | 0 | None | 14 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205662 | 14496 | 0 | None | 14 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130460 | 14496 | 0 | None | 14 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44304350 | 201178 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 369 | 7 | 3 | 3 | 4.4 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccccc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62590 | 201178 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 369 | 7 | 3 | 3 | 4.4 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccccc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44291639 | 183318 | 0 | None | - | 1 | Rat | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 411 | 8 | 2 | 3 | 5.0 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL48117 | 183318 | 0 | None | - | 1 | Rat | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 411 | 8 | 2 | 3 | 5.0 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
54757964 | 65121 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 419 | 8 | 2 | 4 | 4.0 | O=C1CCC(O)=C1CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL1829804 | 65121 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 419 | 8 | 2 | 4 | 4.0 | O=C1CCC(O)=C1CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
11656254 | 77424 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
CHEMBL209134 | 77424 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80104-9 | ||
11676121 | 77919 | 3 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL210964 | 77919 | 3 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
44304384 | 102155 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 7 | 4 | 4 | 4.0 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL304254 | 102155 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 7 | 4 | 4 | 4.0 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
10503252 | 162641 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 440 | 9 | 3 | 5 | 4.2 | N#CN/C(=N/Cc1cccnc1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL418188 | 162641 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 440 | 9 | 3 | 5 | 4.2 | N#CN/C(=N/Cc1cccnc1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44273591 | 76373 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 3.0 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20659 | 76373 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 3.0 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
10762411 | 81474 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 381 | 7 | 3 | 3 | 4.7 | CC(C)(C)NC(=O)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21647 | 81474 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 381 | 7 | 3 | 3 | 4.7 | CC(C)(C)NC(=O)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
10717572 | 98244 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 431 | 8 | 3 | 4 | 4.9 | N#CN/C(=N/C1CCCCC1)Nc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm9707941 | ||
CHEMBL277619 | 98244 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 431 | 8 | 3 | 4 | 4.9 | N#CN/C(=N/C1CCCCC1)Nc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm9707941 | ||
44385934 | 130932 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CCC/C=C/CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL369153 | 130932 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CCC/C=C/CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44387118 | 60490 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 346 | 9 | 1 | 3 | 4.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSc1ccccc1 | 10.1021/jm00125a009 | ||
CHEMBL176190 | 60490 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 346 | 9 | 1 | 3 | 4.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSc1ccccc1 | 10.1021/jm00125a009 | ||
10542153 | 20411 | 1 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
CHEMBL130823 | 20411 | 1 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
54669848 | 65123 | 0 | None | -42 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
CHEMBL1829806 | 65123 | 0 | None | -42 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
9907162 | 14576 | 0 | None | -50 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1206352 | 14576 | 0 | None | -50 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL264516 | 14576 | 0 | None | -50 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740182 | 90913 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402424 | 90913 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
10320462 | 14632 | 0 | None | -34 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207010 | 14632 | 0 | None | -34 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL334501 | 14632 | 0 | None | -34 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740183 | 90914 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402425 | 90914 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757177 | 144212 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 451 | 11 | 2 | 7 | 4.0 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCC)cc1 | 10.1021/jm070427h | ||
CHEMBL390897 | 144212 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 451 | 11 | 2 | 7 | 4.0 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCC)cc1 | 10.1021/jm070427h | ||
11502680 | 97788 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL274415 | 97788 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
18921488 | 14501 | 0 | None | 10 | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205669 | 14501 | 0 | None | 10 | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131894 | 14501 | 0 | None | 10 | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44304262 | 101632 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 387 | 7 | 4 | 5 | 2.2 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL302235 | 101632 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 387 | 7 | 4 | 5 | 2.2 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
11269563 | 141078 | 0 | None | -676 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL385126 | 141078 | 0 | None | -676 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
44353308 | 14638 | 0 | None | 54 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207038 | 14638 | 0 | None | 54 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL340073 | 14638 | 0 | None | 54 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
71450832 | 78092 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL2111862 | 78092 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
44291597 | 14452 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 475 | 10 | 2 | 4 | 5.3 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1205051 | 14452 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 475 | 10 | 2 | 4 | 5.3 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL47605 | 14452 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 475 | 10 | 2 | 4 | 5.3 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44353303 | 14497 | 0 | None | 2 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205664 | 14497 | 0 | None | 2 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131036 | 14497 | 0 | None | 2 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
71740057 | 90909 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402420 | 90909 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
18921526 | 14505 | 0 | None | -46 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205680 | 14505 | 0 | None | -46 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL132659 | 14505 | 0 | None | -46 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44353169 | 19276 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cncnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL129843 | 19276 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cncnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
23276771 | 21153 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1cnccn1 | 10.1021/jm960341g | ||
CHEMBL131415 | 21153 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1cnccn1 | 10.1021/jm960341g | ||
44292126 | 14456 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 4.9 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1205057 | 14456 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 4.9 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL48013 | 14456 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 4.9 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44291705 | 100933 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 439 | 10 | 2 | 3 | 5.8 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL297275 | 100933 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 439 | 10 | 2 | 3 | 5.8 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
51550 | 204036 | 9 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL8273 | 204036 | 9 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1016/S0960-894X(00)80043-8 | ||
10780482 | 20717 | 1 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ncccn1 | 10.1021/jm960341g | ||
CHEMBL131078 | 20717 | 1 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ncccn1 | 10.1021/jm960341g | ||
16756980 | 92849 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
CHEMBL245032 | 92849 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
54757965 | 64949 | 0 | None | -9 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1828642 | 64949 | 0 | None | -9 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
16757174 | 92813 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL244817 | 92813 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
16756978 | 91860 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
CHEMBL242694 | 91860 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
71740559 | 90921 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402432 | 90921 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
10761205 | 83005 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 363 | 7 | 3 | 4 | 3.2 | C/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21960 | 83005 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 363 | 7 | 3 | 4 | 3.2 | C/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
6073 | 3726 | 41 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 10.1021/ml5002085 | ||
9938840 | 3726 | 41 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 10.1021/ml5002085 | ||
CHEMBL2107786 | 3726 | 41 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 10.1021/ml5002085 | ||
18921488 | 14501 | 0 | None | -10 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205669 | 14501 | 0 | None | -10 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131894 | 14501 | 0 | None | -10 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)CCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44304642 | 101771 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 421 | 7 | 4 | 5 | 2.9 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL303114 | 101771 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 421 | 7 | 4 | 5 | 2.9 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273499 | 98282 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 391 | 8 | 2 | 3 | 3.2 | O=C(O)CC/C=C/C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277940 | 98282 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 391 | 8 | 2 | 3 | 3.2 | O=C(O)CC/C=C/C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
54757965 | 64949 | 0 | None | 9 | 2 | Mouse | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1828642 | 64949 | 0 | None | 9 | 2 | Mouse | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
11676145 | 77803 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
CHEMBL210415 | 77803 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
16757380 | 92179 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
CHEMBL243552 | 92179 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
71740180 | 90911 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402422 | 90911 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
16757377 | 149541 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL395079 | 149541 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
9930263 | 98771 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 389 | 8 | 3 | 4 | 3.8 | N#CN/C(=N/C1CC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL281621 | 98771 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 389 | 8 | 3 | 4 | 3.8 | N#CN/C(=N/C1CC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
15745526 | 78012 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 385 | 7 | 4 | 4 | 3.4 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL2111524 | 78012 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 385 | 7 | 4 | 4 | 3.4 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304279 | 101806 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 8 | 3 | 5 | 4.3 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL303284 | 101806 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 8 | 3 | 5 | 4.3 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304265 | 201601 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 439 | 6 | 4 | 4 | 4.3 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64723 | 201601 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 439 | 6 | 4 | 4 | 4.3 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273542 | 98216 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 381 | 10 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277405 | 98216 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 381 | 10 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273435 | 99005 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 423 | 8 | 2 | 3 | 4.2 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL283101 | 99005 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 423 | 8 | 2 | 3 | 4.2 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273742 | 168640 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 373 | 10 | 2 | 4 | 2.4 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL440772 | 168640 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 373 | 10 | 2 | 4 | 2.4 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
10786712 | 82791 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 392 | 8 | 3 | 3 | 4.4 | N/C(=N/C1CCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21851 | 82791 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 392 | 8 | 3 | 3 | 4.4 | N/C(=N/C1CCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm9707941 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm9707941 | ||
11545850 | 69893 | 0 | None | -446 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1021/jm049036i | ||
CHEMBL194085 | 69893 | 0 | None | -446 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1021/jm049036i | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
44291864 | 181050 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 473 | 10 | 2 | 3 | 6.4 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL47743 | 181050 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 473 | 10 | 2 | 3 | 6.4 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1829808 | 65125 | 0 | None | -18 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 433 | 8 | 2 | 4 | 4.2 | CCC1=C(O)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
71740179 | 90910 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402421 | 90910 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
44353310 | 14496 | 0 | None | -14 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205662 | 14496 | 0 | None | -14 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130460 | 14496 | 0 | None | -14 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 351 | 6 | 2 | 3 | 2.3 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)C1CCCCC1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
54757768 | 65124 | 0 | None | - | 1 | Mouse | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 475 | 10 | 1 | 4 | 4.9 | CC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
CHEMBL1829807 | 65124 | 0 | None | - | 1 | Mouse | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 475 | 10 | 1 | 4 | 4.9 | CC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
CHEMBL1829810 | 65127 | 0 | None | 11 | 2 | Mouse | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 447 | 8 | 2 | 4 | 4.5 | CC(C)C1=C(O)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
10524500 | 85080 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 391 | 8 | 3 | 4 | 4.0 | CC(C)/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL22721 | 85080 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 391 | 8 | 3 | 4 | 4.0 | CC(C)/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44305675 | 201285 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 505 | 11 | 1 | 5 | 5.6 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS(=O)(=O)[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL63056 | 201285 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 505 | 11 | 1 | 5 | 5.6 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS(=O)(=O)[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
131717 | 201698 | 4 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL65414 | 201698 | 4 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
131717 | 201698 | 4 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL65414 | 201698 | 4 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
44304271 | 100254 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 421 | 7 | 4 | 5 | 2.9 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL292601 | 100254 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 421 | 7 | 4 | 5 | 2.9 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304264 | 101745 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 455 | 7 | 4 | 5 | 3.5 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL302917 | 101745 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 455 | 7 | 4 | 5 | 3.5 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304297 | 201477 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 437 | 7 | 3 | 3 | 5.7 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64229 | 201477 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 437 | 7 | 3 | 3 | 5.7 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273351 | 73014 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 391 | 10 | 2 | 4 | 2.5 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20133 | 73014 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 391 | 10 | 2 | 4 | 2.5 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273521 | 73597 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 10 | 2 | 5 | 3.2 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20212 | 73597 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 414 | 10 | 2 | 5 | 3.2 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273448 | 74405 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 349 | 8 | 2 | 3 | 3.2 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20308 | 74405 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 349 | 8 | 2 | 3 | 3.2 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273415 | 75011 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 387 | 10 | 2 | 4 | 2.7 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2CCCCOCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20376 | 75011 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 387 | 10 | 2 | 4 | 2.7 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2CCCCOCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273414 | 98276 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 389 | 10 | 2 | 4 | 2.6 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277879 | 98276 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 389 | 10 | 2 | 4 | 2.6 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F | 10.1016/0960-894X(95)00199-4 | ||
44273570 | 98663 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 403 | 9 | 2 | 3 | 3.8 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL280934 | 98663 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 403 | 9 | 2 | 3 | 3.8 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273449 | 98731 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 409 | 10 | 2 | 4 | 2.6 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL281383 | 98731 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 409 | 10 | 2 | 4 | 2.6 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
23276768 | 116260 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL337607 | 116260 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
11676145 | 77803 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
CHEMBL210415 | 77803 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
6436053 | 98258 | 11 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm9707941 | ||
CHEMBL277689 | 98258 | 11 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm9707941 | ||
44304290 | 102215 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 8 | 4 | 7 | 2.1 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL304652 | 102215 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 8 | 4 | 7 | 2.1 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
22882094 | 102284 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 439 | 6 | 4 | 4 | 4.3 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL305114 | 102284 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 439 | 6 | 4 | 4 | 4.3 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
10546960 | 201664 | 0 | None | -6 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2014.07.047 | ||
CHEMBL65121 | 201664 | 0 | None | -6 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2014.07.047 | ||
44273404 | 73841 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 398 | 11 | 2 | 6 | 2.2 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20231 | 73841 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 398 | 11 | 2 | 6 | 2.2 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
44273523 | 74096 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 369 | 8 | 2 | 3 | 3.5 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20274 | 74096 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 369 | 8 | 2 | 3 | 3.5 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273474 | 75604 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.4 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc2ccccc2c1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20524 | 75604 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.4 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc2ccccc2c1 | 10.1016/0960-894X(95)00199-4 | ||
44273402 | 75606 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20525 | 75606 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273387 | 75991 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 421 | 10 | 2 | 4 | 3.6 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20590 | 75991 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 421 | 10 | 2 | 4 | 3.6 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/0960-894X(95)00199-4 | ||
44273502 | 79528 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 369 | 8 | 2 | 3 | 3.2 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL21255 | 79528 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 369 | 8 | 2 | 3 | 3.2 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273588 | 98598 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 383 | 9 | 2 | 3 | 3.4 | Cc1ccc(S(=O)(=O)NC[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL280403 | 98598 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 383 | 9 | 2 | 3 | 3.4 | Cc1ccc(S(=O)(=O)NC[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273780 | 98732 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 367 | 10 | 2 | 4 | 2.6 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2CCCCOCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL281385 | 98732 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 367 | 10 | 2 | 4 | 2.6 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2CCCCOCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273522 | 166393 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 403 | 8 | 2 | 3 | 4.2 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL428707 | 166393 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 403 | 8 | 2 | 3 | 4.2 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/0960-894X(95)00199-4 | ||
44353290 | 14509 | 0 | None | - | 1 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 346 | 6 | 2 | 4 | 1.4 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccnc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205689 | 14509 | 0 | None | - | 1 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 346 | 6 | 2 | 4 | 1.4 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccnc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL134128 | 14509 | 0 | None | - | 1 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 346 | 6 | 2 | 4 | 1.4 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccnc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44385988 | 128497 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 370 | 13 | 2 | 4 | 4.3 | CCCCC(O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL366990 | 128497 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 370 | 13 | 2 | 4 | 4.3 | CCCCC(O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44292084 | 173597 | 0 | None | - | 1 | Rat | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 473 | 8 | 2 | 4 | 5.1 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL45471 | 173597 | 0 | None | - | 1 | Rat | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 473 | 8 | 2 | 4 | 5.1 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
16756978 | 91860 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
CHEMBL242694 | 91860 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
16757488 | 92853 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 437 | 7 | 2 | 7 | 3.6 | CCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL245037 | 92853 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 437 | 7 | 2 | 7 | 3.6 | CCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
16757174 | 92813 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL244817 | 92813 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
11488860 | 19095 | 0 | None | -7762 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290413 | 19095 | 0 | None | -7762 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
16755884 | 92886 | 15 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL245261 | 92886 | 15 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL1829810 | 65127 | 0 | None | -11 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 447 | 8 | 2 | 4 | 4.5 | CC(C)C1=C(O)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
44293931 | 101466 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
CHEMBL301098 | 101466 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
163920 | 14506 | 11 | None | 165 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205685 | 14506 | 11 | None | 165 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL133420 | 14506 | 11 | None | 165 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
15291968 | 100423 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 393 | 6 | 2 | 3 | 3.2 | O=C(O)CCc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/j.bmcl.2014.07.047 | ||
CHEMBL29374 | 100423 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 393 | 6 | 2 | 3 | 3.2 | O=C(O)CCc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/j.bmcl.2014.07.047 | ||
22882109 | 100266 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 7 | 4 | 4 | 4.7 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL292712 | 100266 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 7 | 4 | 4 | 4.7 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
22882097 | 167429 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 416 | 7 | 4 | 6 | 2.9 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL431956 | 167429 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 416 | 7 | 4 | 6 | 2.9 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304362 | 199183 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 432 | 8 | 4 | 7 | 2.1 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL60128 | 199183 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 432 | 8 | 4 | 7 | 2.1 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304641 | 201201 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 7 | 4 | 4 | 4.7 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62702 | 201201 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 7 | 4 | 4 | 4.7 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273434 | 74095 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 419 | 9 | 2 | 3 | 4.4 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20273 | 74095 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 419 | 9 | 2 | 3 | 4.4 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273540 | 79403 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 385 | 11 | 2 | 4 | 2.7 | O=C(O)COCCCCC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL21204 | 79403 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 385 | 11 | 2 | 4 | 2.7 | O=C(O)COCCCCC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273792 | 98900 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 405 | 9 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL282458 | 98900 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 405 | 9 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2F)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273574 | 76652 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 355 | 8 | 2 | 3 | 2.9 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20711 | 76652 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 355 | 8 | 2 | 3 | 2.9 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273796 | 77519 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 353 | 10 | 2 | 4 | 2.3 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20933 | 77519 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 353 | 10 | 2 | 4 | 2.3 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
44273805 | 77921 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 401 | 10 | 2 | 3 | 3.7 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL21097 | 77921 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 401 | 10 | 2 | 3 | 3.7 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273778 | 98930 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 371 | 10 | 2 | 4 | 2.5 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL282652 | 98930 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 371 | 10 | 2 | 4 | 2.5 | O=C(O)COCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273464 | 99147 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 400 | 9 | 2 | 4 | 3.8 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1cccc2cccnc12 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL284019 | 99147 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 400 | 9 | 2 | 4 | 3.8 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1cccc2cccnc12 | 10.1016/0960-894X(95)00199-4 | ||
122197353 | 132944 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 420 | 9 | 2 | 4 | 3.8 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2cccc3cccnc23)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL3706741 | 132944 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 420 | 9 | 2 | 4 | 3.8 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2cccc3cccnc23)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273541 | 98804 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 371 | 8 | 2 | 3 | 3.1 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL281825 | 98804 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 371 | 8 | 2 | 3 | 3.1 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F | 10.1016/0960-894X(95)00199-4 | ||
44386190 | 60098 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 390 | 12 | 1 | 4 | 4.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCOc1ccccc1 | 10.1021/jm00125a009 | ||
CHEMBL175076 | 60098 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 390 | 12 | 1 | 4 | 4.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCOc1ccccc1 | 10.1021/jm00125a009 | ||
44386035 | 128149 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 366 | 10 | 1 | 3 | 5.3 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCC1CCCCC1 | 10.1021/jm00125a009 | ||
CHEMBL366812 | 128149 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 366 | 10 | 1 | 3 | 5.3 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCC1CCCCC1 | 10.1021/jm00125a009 | ||
10637871 | 21618 | 1 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
CHEMBL131949 | 21618 | 1 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
16757080 | 143648 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
CHEMBL390414 | 143648 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
16757381 | 143391 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
CHEMBL390216 | 143391 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
16757376 | 152953 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL397964 | 152953 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1021/jm070427h | ||
71740563 | 90925 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402436 | 90925 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757268 | 91855 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 431 | 5 | 2 | 7 | 3.2 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N/C(=N\C#N)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL242687 | 91855 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 431 | 5 | 2 | 7 | 3.2 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N/C(=N\C#N)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
44273497 | 98308 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 3.5 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL278100 | 98308 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 3.5 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
10500543 | 82787 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 389 | 8 | 3 | 4 | 3.8 | N#CN/C(=N/C1CC1)Nc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm9707941 | ||
CHEMBL21849 | 82787 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 389 | 8 | 3 | 4 | 3.8 | N#CN/C(=N/C1CC1)Nc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm9707941 | ||
10833696 | 167958 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(\c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL435412 | 167958 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(\c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
16757083 | 142066 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
CHEMBL389135 | 142066 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
54757771 | 65130 | 0 | None | -8 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 515 | 12 | 1 | 4 | 5.7 | CC(C)COC1=C(CC2CC2)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829813 | 65130 | 0 | None | -8 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 515 | 12 | 1 | 4 | 5.7 | CC(C)COC1=C(CC2CC2)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
16757486 | 92779 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
CHEMBL244608 | 92779 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
44305343 | 100215 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL292331 | 100215 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
10409713 | 14500 | 0 | None | 42 | 2 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205668 | 14500 | 0 | None | 42 | 2 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131497 | 14500 | 0 | None | 42 | 2 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44291635 | 14616 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.6 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1206702 | 14616 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.6 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL298462 | 14616 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 5.6 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
71740559 | 90921 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402432 | 90921 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
44273462 | 74059 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 335 | 8 | 2 | 3 | 2.9 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20257 | 74059 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 335 | 8 | 2 | 3 | 2.9 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
11633163 | 138307 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
CHEMBL378137 | 138307 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
71740179 | 90910 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402421 | 90910 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
44305452 | 201670 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CCC/C=C\C[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL65161 | 201670 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CCC/C=C\C[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
44304473 | 201211 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 369 | 7 | 3 | 3 | 4.4 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccccc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62739 | 201211 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 369 | 7 | 3 | 3 | 4.4 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccccc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273506 | 77842 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 349 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL21057 | 77842 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 349 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/0960-894X(95)00199-4 | ||
16756977 | 91858 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
CHEMBL242692 | 91858 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
71740560 | 90922 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402433 | 90922 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
71740180 | 90911 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402422 | 90911 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
16757080 | 143648 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
CHEMBL390414 | 143648 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
44305478 | 100276 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 505 | 11 | 1 | 5 | 5.6 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)S(=O)(=O)C[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL292740 | 100276 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 505 | 11 | 1 | 5 | 5.6 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)S(=O)(=O)C[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
15018463 | 168814 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 389 | 10 | 2 | 3 | 3.6 | O=C(O)CCCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL442143 | 168814 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 389 | 10 | 2 | 3 | 3.6 | O=C(O)CCCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
10661867 | 20377 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cnccn1 | 10.1021/jm960341g | ||
CHEMBL130790 | 20377 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cnccn1 | 10.1021/jm960341g | ||
16757381 | 143391 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
CHEMBL390216 | 143391 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
13720717 | 77498 | 0 | None | 1 | 3 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 363 | 5 | 3 | 6 | 2.7 | COc1cc(C[C@H]2NCCc3cc(O)c(O)c(F)c32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
CHEMBL2092996 | 77498 | 0 | None | 1 | 3 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 363 | 5 | 3 | 6 | 2.7 | COc1cc(C[C@H]2NCCc3cc(O)c(O)c(F)c32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
54669847 | 65122 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829805 | 65122 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
44273489 | 73797 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 363 | 9 | 2 | 3 | 3.6 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2C/C=C\CCCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20228 | 73797 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 363 | 9 | 2 | 3 | 3.6 | Cc1ccc(S(=O)(=O)N[C@H]2CCC=C2C/C=C\CCCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
23276770 | 117985 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL341426 | 117985 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1ccncn1 | 10.1021/jm960341g | ||
44386678 | 167784 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 386 | 13 | 1 | 4 | 4.0 | CCCCCCS(=O)(=O)CC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL434362 | 167784 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 386 | 13 | 1 | 4 | 4.0 | CCCCCCS(=O)(=O)CC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
10852668 | 19370 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL129995 | 19370 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
10827996 | 115685 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL335841 | 115685 | 1 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
54757771 | 65130 | 0 | None | 8 | 2 | Mouse | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 515 | 12 | 1 | 4 | 5.7 | CC(C)COC1=C(CC2CC2)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829813 | 65130 | 0 | None | 8 | 2 | Mouse | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 515 | 12 | 1 | 4 | 5.7 | CC(C)COC1=C(CC2CC2)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
11633163 | 138307 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
CHEMBL378137 | 138307 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C)c1 | 10.1021/jm070427h | ||
16756980 | 92849 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
CHEMBL245032 | 92849 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
54757770 | 65128 | 0 | None | 20 | 2 | Mouse | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 503 | 11 | 1 | 4 | 5.6 | CC(C)COC1=C(C(C)C)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829811 | 65128 | 0 | None | 20 | 2 | Mouse | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 503 | 11 | 1 | 4 | 5.6 | CC(C)COC1=C(C(C)C)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
9907162 | 14576 | 0 | None | 50 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1206352 | 14576 | 0 | None | 50 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL264516 | 14576 | 0 | None | 50 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.7 | O=C(O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
15018450 | 72617 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 383 | 9 | 2 | 3 | 3.6 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20065 | 72617 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 383 | 9 | 2 | 3 | 3.6 | Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](F)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1016/0960-894X(95)00199-4 | ||
10669025 | 203347 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C/CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL7718 | 203347 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C/CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44291875 | 101009 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 459 | 9 | 2 | 3 | 6.0 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL297808 | 101009 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 459 | 9 | 2 | 3 | 6.0 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44304706 | 201597 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 371 | 6 | 4 | 4 | 3.0 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64707 | 201597 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 371 | 6 | 4 | 4 | 3.0 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
16757376 | 152953 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL397964 | 152953 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1021/jm070427h | ||
16757175 | 92814 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 437 | 10 | 2 | 7 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 | 10.1021/jm070427h | ||
CHEMBL244818 | 92814 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 437 | 10 | 2 | 7 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 | 10.1021/jm070427h | ||
10546960 | 201664 | 0 | None | 6 | 2 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL65121 | 201664 | 0 | None | 6 | 2 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
10550018 | 161710 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 419 | 10 | 3 | 4 | 4.7 | CC(C)CC/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL416374 | 161710 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 419 | 10 | 3 | 4 | 4.7 | CC(C)CC/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
16757176 | 92852 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 465 | 12 | 2 | 7 | 4.4 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCCC)cc1 | 10.1021/jm070427h | ||
CHEMBL245036 | 92852 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 465 | 12 | 2 | 7 | 4.4 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCCC)cc1 | 10.1021/jm070427h | ||
71740444 | 90918 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402429 | 90918 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
117630015 | 115369 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 591 | 9 | 1 | 4 | 7.0 | Cc1cccc(C)c1C1=C(OCC(C)C)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
CHEMBL3354617 | 115369 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 591 | 9 | 1 | 4 | 7.0 | Cc1cccc(C)c1C1=C(OCC(C)C)CC(Cc2cccc3c2CCC(NS(=O)(=O)c2ccc(Cl)cc2)C3)C1=O | 10.1021/ml5002085 | ||
11676121 | 77919 | 3 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL210964 | 77919 | 3 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
5581 | 101188 | 10 | None | -208 | 6 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
CHEMBL299175 | 101188 | 10 | None | -208 | 6 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
15290043 | 14633 | 0 | None | -33 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207012 | 14633 | 0 | None | -33 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL335043 | 14633 | 0 | None | -33 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
18921481 | 14495 | 0 | None | -81 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205661 | 14495 | 0 | None | -81 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130377 | 14495 | 0 | None | -81 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
117630458 | 115371 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 521 | 7 | 2 | 4 | 5.4 | O=C1C(Cc2ccccc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
CHEMBL3354619 | 115371 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 521 | 7 | 2 | 4 | 5.4 | O=C1C(Cc2ccccc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
10385168 | 116080 | 0 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(/c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL336548 | 116080 | 0 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 381 | 9 | 1 | 5 | 3.9 | O=C(O)CCCCCO/N=C(/c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
11633215 | 139625 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL380274 | 139625 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
15290042 | 14704 | 0 | None | 162 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207638 | 14704 | 0 | None | 162 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL422441 | 14704 | 0 | None | 162 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740560 | 90922 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402433 | 90922 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
10646254 | 80727 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 429 | 9 | 3 | 6 | 4.8 | CC(C)(C)NC(Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)=C(C#N)C#N | 10.1021/jm9707941 | ||
CHEMBL21570 | 80727 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 429 | 9 | 3 | 6 | 4.8 | CC(C)(C)NC(Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)=C(C#N)C#N | 10.1021/jm9707941 | ||
219052 | 14635 | 2 | None | 120 | 2 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207021 | 14635 | 2 | None | 120 | 2 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL336846 | 14635 | 2 | None | 120 | 2 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
54669848 | 65123 | 0 | None | 42 | 2 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
CHEMBL1829806 | 65123 | 0 | None | 42 | 2 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
117630548 | 115366 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 507 | 6 | 2 | 4 | 5.3 | O=C1C(c2ccccc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
CHEMBL3354614 | 115366 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 507 | 6 | 2 | 4 | 5.3 | O=C1C(c2ccccc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
10669649 | 81293 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 417 | 8 | 3 | 4 | 4.5 | N#CN/C(=N/C1CCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21639 | 81293 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 417 | 8 | 3 | 4 | 4.5 | N#CN/C(=N/C1CCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
11661725 | 77506 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
CHEMBL209306 | 77506 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
10503638 | 164257 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 448 | 10 | 4 | 6 | 3.8 | CC(C)C/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)Nc1nn[nH]n1 | 10.1021/jm9707941 | ||
CHEMBL421854 | 164257 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 448 | 10 | 4 | 6 | 3.8 | CC(C)C/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)Nc1nn[nH]n1 | 10.1021/jm9707941 | ||
11567679 | 77395 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL209035 | 77395 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
10494367 | 19305 | 1 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ncccn1 | 10.1021/jm960341g | ||
CHEMBL129935 | 19305 | 1 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ncccn1 | 10.1021/jm960341g | ||
10518244 | 21728 | 1 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL132043 | 21728 | 1 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
16757486 | 92779 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
CHEMBL244608 | 92779 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
71740183 | 90914 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402425 | 90914 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757081 | 92433 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
CHEMBL243983 | 92433 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
16757079 | 92413 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
CHEMBL243773 | 92413 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
18921526 | 14505 | 0 | None | 46 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205680 | 14505 | 0 | None | 46 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL132659 | 14505 | 0 | None | 46 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.1 | O=C(O)Cc1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44457587 | 83082 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 436 | 9 | 3 | 6 | 3.7 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=N\OCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL22023 | 83082 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 436 | 9 | 3 | 6 | 3.7 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=N\OCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
16756981 | 152070 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
CHEMBL397198 | 152070 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
71740557 | 90919 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402430 | 90919 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
10717914 | 168542 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 439 | 9 | 3 | 4 | 4.8 | N#CN/C(=N/Cc1ccccc1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL440096 | 168542 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 439 | 9 | 3 | 4 | 4.8 | N#CN/C(=N/Cc1ccccc1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44353303 | 14497 | 0 | None | -2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205664 | 14497 | 0 | None | -2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131036 | 14497 | 0 | None | -2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 381 | 6 | 2 | 4 | 2.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)O2 | 10.1016/s0960-894x(99)00014-1 | ||
10526115 | 80103 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 419 | 8 | 3 | 4 | 4.8 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21478 | 80103 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 419 | 8 | 3 | 4 | 4.8 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
10766313 | 98246 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 458 | 8 | 3 | 5 | 3.9 | CC(C)(C)/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NS(C)(=O)=O | 10.1021/jm9707941 | ||
CHEMBL277620 | 98246 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 458 | 8 | 3 | 5 | 3.9 | CC(C)(C)/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NS(C)(=O)=O | 10.1021/jm9707941 | ||
10637870 | 20324 | 1 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
CHEMBL130755 | 20324 | 1 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
10545734 | 166394 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 349 | 7 | 3 | 4 | 2.8 | N#CN/C(N)=N\c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL428709 | 166394 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 349 | 7 | 3 | 4 | 2.8 | N#CN/C(N)=N\c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
18921481 | 14495 | 0 | None | 81 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205661 | 14495 | 0 | None | 81 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130377 | 14495 | 0 | None | 81 | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)CCCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44385759 | 60136 | 0 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.4 | CCCCCCCSC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL175325 | 60136 | 0 | None | - | 1 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.4 | CCCCCCCSC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
163920 | 14506 | 11 | None | -165 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205685 | 14506 | 11 | None | -165 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL133420 | 14506 | 11 | None | -165 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 365 | 5 | 2 | 3 | 2.4 | O=C(O)Cc1ccc2c(c1)CC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
219052 | 14635 | 2 | None | -120 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207021 | 14635 | 2 | None | -120 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL336846 | 14635 | 2 | None | -120 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 2.7 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
10384315 | 164594 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cncnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL422793 | 164594 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cncnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
71740057 | 90909 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402420 | 90909 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
1986 | 1285 | 46 | None | 7 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
54343 | 1285 | 46 | None | 7 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL71685 | 1285 | 46 | None | 7 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
44387046 | 61806 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCSCCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL177760 | 61806 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCSCCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
16757179 | 92888 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 455 | 9 | 2 | 6 | 4.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)c(C)c1 | 10.1021/jm070427h | ||
CHEMBL245263 | 92888 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 455 | 9 | 2 | 6 | 4.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)c(C)c1 | 10.1021/jm070427h | ||
16756977 | 91858 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
CHEMBL242692 | 91858 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
54758054 | 65119 | 0 | None | -4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
CHEMBL1829802 | 65119 | 0 | None | -4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
10620837 | 98724 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 397 | 7 | 3 | 3 | 5.3 | CC(C)(C)/N=C(/S)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL281338 | 98724 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 397 | 7 | 3 | 3 | 5.3 | CC(C)(C)/N=C(/S)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
11647396 | 77429 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL209168 | 77429 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
10320462 | 14632 | 0 | None | 34 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207010 | 14632 | 0 | None | 34 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL334501 | 14632 | 0 | None | 34 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)CCCc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44386034 | 60069 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 368 | 13 | 1 | 3 | 5.7 | CCCCCC(C)SCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL174856 | 60069 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 368 | 13 | 1 | 3 | 5.7 | CCCCCC(C)SCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
118719206 | 114965 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CCC(O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL3350918 | 114965 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CCC(O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
56659855 | 64987 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 353 | 7 | 2 | 8 | -0.1 | NC(=O)c1c(CSCC(=O)Oc2ccccc2C(=O)O)no[n+]1[O-] | 10.1016/j.bmc.2011.08.018 | ||
CHEMBL1829095 | 64987 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 353 | 7 | 2 | 8 | -0.1 | NC(=O)c1c(CSCC(=O)Oc2ccccc2C(=O)O)no[n+]1[O-] | 10.1016/j.bmc.2011.08.018 | ||
44386134 | 62025 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 284 | 8 | 1 | 3 | 3.3 | CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL177907 | 62025 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 284 | 8 | 1 | 3 | 3.3 | CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
54757769 | 65126 | 0 | None | -8 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 5.3 | CCC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
CHEMBL1829809 | 65126 | 0 | None | -8 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 5.3 | CCC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
16757079 | 92413 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
CHEMBL243773 | 92413 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Cl | 10.1021/jm070427h | ||
71740308 | 90927 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 391 | 4 | 2 | 5 | 3.3 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402438 | 90927 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 391 | 4 | 2 | 5 | 3.3 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
10095268 | 85729 | 0 | None | -7 | 3 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 449 | 6 | 1 | 3 | 6.8 | Cc1ccc(-n2c(C)ccc2-c2cc(Cl)ccc2OCc2ccc(F)cc2)cc1C(=O)O | 10.1016/j.bmcl.2006.11.059 | ||
CHEMBL231184 | 85729 | 0 | None | -7 | 3 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 449 | 6 | 1 | 3 | 6.8 | Cc1ccc(-n2c(C)ccc2-c2cc(Cl)ccc2OCc2ccc(F)cc2)cc1C(=O)O | 10.1016/j.bmcl.2006.11.059 | ||
56680341 | 64988 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 337 | 7 | 2 | 8 | 0.7 | NC(=O)c1nonc1CSCC(=O)Oc1ccccc1C(=O)O | 10.1016/j.bmc.2011.08.018 | ||
CHEMBL1829096 | 64988 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 337 | 7 | 2 | 8 | 0.7 | NC(=O)c1nonc1CSCC(=O)Oc1ccccc1C(=O)O | 10.1016/j.bmc.2011.08.018 | ||
16757377 | 149541 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL395079 | 149541 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
13720716 | 62724 | 0 | None | -165 | 3 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 363 | 5 | 3 | 6 | 2.7 | COc1cc(C[C@@H]2NCCc3cc(O)c(O)c(F)c32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
CHEMBL1788251 | 62724 | 0 | None | -165 | 3 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 363 | 5 | 3 | 6 | 2.7 | COc1cc(C[C@@H]2NCCc3cc(O)c(O)c(F)c32)cc(OC)c1OC | 10.1021/jm00081a007 | ||
16757081 | 92433 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
CHEMBL243983 | 92433 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
16757083 | 142066 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
CHEMBL389135 | 142066 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(I)cc1 | 10.1021/jm070427h | ||
44138108 | 183703 | 0 | None | -7413 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483991 | 183703 | 0 | None | -7413 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
56680464 | 65129 | 0 | None | -7 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 3.8 | O=C1C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC(O)C1CC1CC1 | 10.1021/jm200980u | ||
CHEMBL1829812 | 65129 | 0 | None | -7 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 3.8 | O=C1C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC(O)C1CC1CC1 | 10.1021/jm200980u | ||
71740561 | 90923 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402434 | 90923 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16756982 | 92884 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
CHEMBL245254 | 92884 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
16757375 | 91755 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
CHEMBL242479 | 91755 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
44387050 | 60976 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 368 | 14 | 1 | 3 | 5.7 | CCCCCCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL176714 | 60976 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 368 | 14 | 1 | 3 | 5.7 | CCCCCCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
71740561 | 90923 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402434 | 90923 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757378 | 92848 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 393 | 7 | 2 | 6 | 3.1 | CCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm070427h | ||
CHEMBL245031 | 92848 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 393 | 7 | 2 | 6 | 3.1 | CCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm070427h | ||
16756981 | 152070 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
CHEMBL397198 | 152070 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1Br | 10.1021/jm070427h | ||
11656254 | 77424 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
CHEMBL209134 | 77424 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
11294166 | 76692 | 0 | None | -10232 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207203 | 76692 | 0 | None | -10232 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
11294166 | 76692 | 0 | None | -10232 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL207203 | 76692 | 0 | None | -10232 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
71740308 | 90927 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 391 | 4 | 2 | 5 | 3.3 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402438 | 90927 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 391 | 4 | 2 | 5 | 3.3 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44457567 | 79858 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 450 | 11 | 3 | 6 | 5.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(N/C(=C/[N+](=O)[O-])NC2CCCCC2)c1 | 10.1021/jm9707941 | ||
CHEMBL21392 | 79858 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 450 | 11 | 3 | 6 | 5.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(N/C(=C/[N+](=O)[O-])NC2CCCCC2)c1 | 10.1021/jm9707941 | ||
44273488 | 99012 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 367 | 9 | 2 | 3 | 3.4 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL283128 | 99012 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 367 | 9 | 2 | 3 | 3.4 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
16757175 | 92814 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 437 | 10 | 2 | 7 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 | 10.1021/jm070427h | ||
CHEMBL244818 | 92814 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 437 | 10 | 2 | 7 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 | 10.1021/jm070427h | ||
16757378 | 92848 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 393 | 7 | 2 | 6 | 3.1 | CCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm070427h | ||
CHEMBL245031 | 92848 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 393 | 7 | 2 | 6 | 3.1 | CCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm070427h | ||
11568384 | 77443 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
CHEMBL209245 | 77443 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
11510008 | 76929 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
CHEMBL208115 | 76929 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
16757485 | 92749 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
CHEMBL244401 | 92749 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
44305343 | 100215 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL292331 | 100215 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
44305326 | 201237 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)SC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL62834 | 201237 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)SC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
11604299 | 139052 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL379736 | 139052 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
1986 | 1285 | 46 | None | -7 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
54343 | 1285 | 46 | None | -7 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL71685 | 1285 | 46 | None | -7 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1016/s0960-894x(99)00014-1 | ||
9802748 | 135400 | 0 | None | -229 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CN([C@@H]1CCc2c(c3ccccc3n2CCC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | ||
CHEMBL373118 | 135400 | 0 | None | -229 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CN([C@@H]1CCc2c(c3ccccc3n2CCC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | ||
54757769 | 65126 | 0 | None | 8 | 2 | Mouse | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 5.3 | CCC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
CHEMBL1829809 | 65126 | 0 | None | 8 | 2 | Mouse | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 5.3 | CCC1=C(OCC(C)C)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
71740668 | 90906 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 390 | 4 | 3 | 5 | 3.2 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402417 | 90906 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 390 | 4 | 3 | 5 | 3.2 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
10526677 | 98970 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 431 | 8 | 3 | 4 | 4.9 | N#CN/C(=N/C1CCCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL282884 | 98970 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 431 | 8 | 3 | 4 | 4.9 | N#CN/C(=N/C1CCCCC1)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
11568248 | 138126 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
CHEMBL377679 | 138126 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
16757082 | 92619 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
CHEMBL244190 | 92619 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
44273463 | 161288 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 389 | 10 | 2 | 3 | 3.5 | O=C(O)CCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL414609 | 161288 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 389 | 10 | 2 | 3 | 3.5 | O=C(O)CCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
10756561 | 20075 | 1 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1cnccn1 | 10.1021/jm960341g | ||
CHEMBL130564 | 20075 | 1 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(\c1ccccc1)c1cnccn1 | 10.1021/jm960341g | ||
71740444 | 90918 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402429 | 90918 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1016/j.ejmech.2013.04.033 | ||
15290042 | 14704 | 0 | None | -162 | 2 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207638 | 14704 | 0 | None | -162 | 2 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL422441 | 14704 | 0 | None | -162 | 2 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc3ccccc13)C2 | 10.1016/s0960-894x(99)00014-1 | ||
16757176 | 92852 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 465 | 12 | 2 | 7 | 4.4 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCCC)cc1 | 10.1021/jm070427h | ||
CHEMBL245036 | 92852 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 465 | 12 | 2 | 7 | 4.4 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCCC)cc1 | 10.1021/jm070427h | ||
71740668 | 90906 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 390 | 4 | 3 | 5 | 3.2 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402417 | 90906 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 390 | 4 | 3 | 5 | 3.2 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
56680464 | 65129 | 0 | None | 7 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 3.8 | O=C1C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC(O)C1CC1CC1 | 10.1021/jm200980u | ||
CHEMBL1829812 | 65129 | 0 | None | 7 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 461 | 9 | 2 | 4 | 3.8 | O=C1C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC(O)C1CC1CC1 | 10.1021/jm200980u | ||
22882112 | 201650 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 430 | 8 | 4 | 6 | 3.3 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64977 | 201650 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 430 | 8 | 4 | 6 | 3.3 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
11676121 | 77919 | 3 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL210964 | 77919 | 3 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
44385825 | 59376 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 388 | 12 | 1 | 3 | 5.3 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCCc1ccccc1 | 10.1021/jm00125a009 | ||
CHEMBL172265 | 59376 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 388 | 12 | 1 | 3 | 5.3 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCCc1ccccc1 | 10.1021/jm00125a009 | ||
10686658 | 18675 | 1 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
CHEMBL128188 | 18675 | 1 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\c1ccccc1)c1ccncn1 | 10.1021/jm960341g | ||
16756877 | 91754 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)C | 10.1021/jm070427h | ||
CHEMBL242478 | 91754 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)C | 10.1021/jm070427h | ||
5311234 | 114641 | 19 | None | -257 | 4 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
CHEMBL334398 | 114641 | 19 | None | -257 | 4 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | ||
70684971 | 77501 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 436 | 9 | 3 | 6 | 3.7 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=N/OCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL2093006 | 77501 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 436 | 9 | 3 | 6 | 3.7 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=N/OCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
18921515 | 14494 | 0 | None | 141 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205659 | 14494 | 0 | None | 141 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130170 | 14494 | 0 | None | 141 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
16755885 | 144219 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 437 | 6 | 2 | 7 | 3.5 | COc1cc(C)ccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
CHEMBL390899 | 144219 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 437 | 6 | 2 | 7 | 3.5 | COc1cc(C)ccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
54669847 | 65122 | 0 | None | 4 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829805 | 65122 | 0 | None | 4 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
11531590 | 77540 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL209406 | 77540 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
44304533 | 100145 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 416 | 7 | 4 | 6 | 2.9 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL291865 | 100145 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 416 | 7 | 4 | 6 | 2.9 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304296 | 201341 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 405 | 6 | 4 | 4 | 3.6 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL63382 | 201341 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 405 | 6 | 4 | 4 | 3.6 | O=C(O)CC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
23276769 | 20164 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1ncccn1 | 10.1021/jm960341g | ||
CHEMBL130623 | 20164 | 0 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1cccc(C(F)(F)F)c1)c1ncccn1 | 10.1021/jm960341g | ||
10546960 | 201664 | 0 | None | -6 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
CHEMBL65121 | 201664 | 0 | None | -6 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
16757380 | 92179 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
CHEMBL243552 | 92179 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Br)cc1 | 10.1021/jm070427h | ||
11704760 | 77258 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL208818 | 77258 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
71740311 | 90936 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 407 | 4 | 2 | 5 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402576 | 90936 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 407 | 4 | 2 | 5 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16755885 | 144219 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 437 | 6 | 2 | 7 | 3.5 | COc1cc(C)ccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
CHEMBL390899 | 144219 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 437 | 6 | 2 | 7 | 3.5 | COc1cc(C)ccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm070427h | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
54757770 | 65128 | 0 | None | -20 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 503 | 11 | 1 | 4 | 5.6 | CC(C)COC1=C(C(C)C)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829811 | 65128 | 0 | None | -20 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 503 | 11 | 1 | 4 | 5.6 | CC(C)COC1=C(C(C)C)C(=O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
71740438 | 90900 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 451 | 4 | 2 | 5 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402411 | 90900 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 451 | 4 | 2 | 5 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
11662021 | 139023 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
CHEMBL379659 | 139023 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
71138349 | 113514 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)=C1O | 10.1016/j.bmcl.2014.07.047 | ||
CHEMBL3326602 | 113514 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)=C1O | 10.1016/j.bmcl.2014.07.047 | ||
15018459 | 98807 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.4 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL281849 | 98807 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.4 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44386125 | 60052 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 298 | 9 | 1 | 3 | 3.7 | CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL174662 | 60052 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 298 | 9 | 1 | 3 | 3.7 | CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44292032 | 14615 | 0 | None | - | 1 | Rat | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 509 | 8 | 2 | 5 | 4.6 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1206700 | 14615 | 0 | None | - | 1 | Rat | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 509 | 8 | 2 | 5 | 4.6 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL297989 | 14615 | 0 | None | - | 1 | Rat | 4.3 | pIC50 | = | 4.3 | Functional | ChEMBL | 509 | 8 | 2 | 5 | 4.6 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
10697301 | 82989 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 520 | 9 | 3 | 5 | 5.3 | CC(C)(C)/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NS(=O)(=O)c1ccccc1 | 10.1021/jm9707941 | ||
CHEMBL21954 | 82989 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 520 | 9 | 3 | 5 | 5.3 | CC(C)(C)/N=C(\Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1)NS(=O)(=O)c1ccccc1 | 10.1021/jm9707941 | ||
11633215 | 139625 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL380274 | 139625 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11502680 | 97788 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL274415 | 97788 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11697902 | 77948 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL211008 | 77948 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
44273436 | 98191 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 418 | 11 | 2 | 6 | 2.3 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277241 | 98191 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 418 | 11 | 2 | 6 | 2.3 | O=C(O)COCCCC[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44386325 | 131324 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 374 | 11 | 1 | 3 | 5.0 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCc1ccccc1 | 10.1021/jm00125a009 | ||
CHEMBL369458 | 131324 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 374 | 11 | 1 | 3 | 5.0 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSCCc1ccccc1 | 10.1021/jm00125a009 | ||
71740441 | 90903 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 499 | 4 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402414 | 90903 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 499 | 4 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740441 | 90903 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 499 | 4 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402414 | 90903 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 499 | 4 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
11531590 | 77540 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL209406 | 77540 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11661725 | 77506 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
CHEMBL209306 | 77506 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
44273498 | 161834 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 400 | 9 | 2 | 5 | 2.8 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL416551 | 161834 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 400 | 9 | 2 | 5 | 2.8 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
71740311 | 90936 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 407 | 4 | 2 | 5 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402576 | 90936 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 407 | 4 | 2 | 5 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757179 | 92888 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 455 | 9 | 2 | 6 | 4.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)c(C)c1 | 10.1021/jm070427h | ||
CHEMBL245263 | 92888 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 455 | 9 | 2 | 6 | 4.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)c(C)c1 | 10.1021/jm070427h | ||
44305481 | 201240 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)[S+]([O-])C[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL62852 | 201240 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)[S+]([O-])C[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80103-7 | ||
11567679 | 77395 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL209035 | 77395 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
70685025 | 77614 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CCC/C=C\CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL2096755 | 77614 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CCC/C=C\CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
16757268 | 91855 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 431 | 5 | 2 | 7 | 3.2 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N/C(=N\C#N)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL242687 | 91855 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 431 | 5 | 2 | 7 | 3.2 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N/C(=N\C#N)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
11567679 | 77395 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL209035 | 77395 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11704760 | 77258 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL208818 | 77258 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
44304557 | 201197 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 414 | 8 | 3 | 5 | 4.3 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62671 | 201197 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 414 | 8 | 3 | 5 | 4.3 | O=C(O)CCC/C=C1\C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
16756982 | 92884 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
CHEMBL245254 | 92884 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 485 | 9 | 2 | 6 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
71740438 | 90900 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 451 | 4 | 2 | 5 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402411 | 90900 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 451 | 4 | 2 | 5 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71138563 | 114010 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 481 | 8 | 2 | 4 | 5.0 | O=C1C(c2ccccc2)=C(O)CC1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
CHEMBL3335482 | 114010 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 481 | 8 | 2 | 4 | 5.0 | O=C1C(c2ccccc2)=C(O)CC1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
16757379 | 92883 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
CHEMBL245253 | 92883 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
15290041 | 14502 | 0 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 359 | 7 | 2 | 3 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)Cc1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205676 | 14502 | 0 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 359 | 7 | 2 | 3 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)Cc1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL132573 | 14502 | 0 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 359 | 7 | 2 | 3 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)Cc1ccccc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
117631097 | 115367 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 525 | 6 | 2 | 4 | 5.4 | O=C1C(c2ccc(F)cc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
CHEMBL3354615 | 115367 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 525 | 6 | 2 | 4 | 5.4 | O=C1C(c2ccc(F)cc2)=C(O)CC1Cc1cccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/ml5002085 | ||
44304559 | 100119 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 455 | 7 | 4 | 5 | 3.5 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL291651 | 100119 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 455 | 7 | 4 | 5 | 3.5 | O=C(O)COC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44304263 | 201370 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 430 | 8 | 4 | 6 | 3.3 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL63602 | 201370 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 430 | 8 | 4 | 6 | 3.3 | O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
22882110 | 201514 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 419 | 7 | 4 | 4 | 4.0 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64349 | 201514 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 419 | 7 | 4 | 4 | 4.0 | O=C(O)CCC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
11510008 | 76929 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
CHEMBL208115 | 76929 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
22882095 | 100553 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 405 | 6 | 4 | 4 | 3.6 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL294516 | 100553 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 405 | 6 | 4 | 4 | 3.6 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3cccc(Cl)c3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
22882098 | 201559 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 371 | 6 | 4 | 4 | 3.0 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL64561 | 201559 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 371 | 6 | 4 | 4 | 3.0 | O=C(O)CC/C=C1/C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273539 | 79400 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 367 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\CC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL21203 | 79400 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 367 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\CC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44273524 | 98872 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 380 | 9 | 2 | 5 | 2.8 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL282225 | 98872 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 380 | 9 | 2 | 5 | 2.8 | O=C(O)CC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
11683470 | 77010 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL208543 | 77010 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
44304222 | 198634 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 387 | 7 | 4 | 5 | 2.2 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL59745 | 198634 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 387 | 7 | 4 | 5 | 2.2 | O=C(O)COC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=N/NC(=O)Nc3ccccc3)[C@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44273260 | 98225 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 403 | 11 | 2 | 3 | 3.9 | O=C(O)CCCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277460 | 98225 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 403 | 11 | 2 | 3 | 3.9 | O=C(O)CCCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
10451585 | 22113 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
CHEMBL132385 | 22113 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(/c1ccnnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm960341g | ||
10546960 | 201664 | 0 | None | -6 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL65121 | 201664 | 0 | None | -6 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
10764758 | 84471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 423 | 9 | 4 | 4 | 3.9 | CC(C)C/N=C(/NC(N)=O)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL22363 | 84471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 423 | 9 | 4 | 4 | 3.9 | CC(C)C/N=C(/NC(N)=O)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
71740056 | 90908 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402419 | 90908 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44273538 | 98248 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 369 | 10 | 2 | 3 | 3.6 | O=C(O)CCCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL277629 | 98248 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 369 | 10 | 2 | 3 | 3.6 | O=C(O)CCCCCCC1=CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
71740185 | 90916 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402427 | 90916 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44273447 | 75842 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 437 | 9 | 2 | 3 | 4.6 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20583 | 75842 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 437 | 9 | 2 | 3 | 4.6 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44385450 | 129776 | 0 | None | - | 1 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 370 | 13 | 1 | 3 | 4.3 | CCCCCC[S+]([O-])CC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL368006 | 129776 | 0 | None | - | 1 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 370 | 13 | 1 | 3 | 4.3 | CCCCCC[S+]([O-])CC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
54758053 | 65118 | 0 | None | -8 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1829801 | 65118 | 0 | None | -8 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
11568384 | 77443 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
CHEMBL209245 | 77443 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
11647396 | 77429 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL209168 | 77429 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
71740669 | 90907 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 404 | 8 | 3 | 5 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402418 | 90907 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 404 | 8 | 3 | 5 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44273475 | 74244 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 405 | 11 | 2 | 4 | 2.7 | O=C(O)COCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20298 | 74244 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 405 | 11 | 2 | 4 | 2.7 | O=C(O)COCCCC[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273402 | 75606 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20525 | 75606 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@@H]1[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
44273412 | 76907 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@H]1[C@@H](F)CC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20797 | 76907 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 9 | 2 | 3 | 3.3 | O=C(O)CC/C=C\C[C@H]1[C@@H](F)CC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00199-4 | ||
44304226 | 198823 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 403 | 7 | 3 | 3 | 5.1 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3cccc(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL59875 | 198823 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 403 | 7 | 3 | 3 | 5.1 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3cccc(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
44292083 | 14448 | 0 | None | - | 1 | Rat | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 475 | 8 | 2 | 5 | 4.0 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1205041 | 14448 | 0 | None | - | 1 | Rat | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 475 | 8 | 2 | 5 | 4.0 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL45623 | 14448 | 0 | None | - | 1 | Rat | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 475 | 8 | 2 | 5 | 4.0 | CC(C)c1ccc2c(CCCC(=O)NS(=O)(=O)c3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
18921514 | 14634 | 0 | None | 117 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207018 | 14634 | 0 | None | 117 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL336352 | 14634 | 0 | None | 117 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
18921516 | 14637 | 0 | None | -77 | 2 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207036 | 14637 | 0 | None | -77 | 2 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL339994 | 14637 | 0 | None | -77 | 2 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
11502680 | 97788 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL274415 | 97788 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
16757375 | 91755 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
CHEMBL242479 | 91755 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C | 10.1021/jm070427h | ||
71740669 | 90907 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 404 | 8 | 3 | 5 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402418 | 90907 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 404 | 8 | 3 | 5 | 3.6 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740182 | 90913 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402424 | 90913 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1cccc(C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
71740184 | 90915 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402426 | 90915 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44273483 | 74501 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 394 | 10 | 2 | 5 | 3.2 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20316 | 74501 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 394 | 10 | 2 | 5 | 3.2 | O=C(O)CCC/C=C\CC1=CCC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] | 10.1016/0960-894X(95)00199-4 | ||
16757379 | 92883 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
CHEMBL245253 | 92883 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 471 | 5 | 2 | 6 | 3.9 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Br)c1 | 10.1021/jm070427h | ||
71740181 | 90912 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402423 | 90912 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1cccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
16757483 | 143395 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
CHEMBL390217 | 143395 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
10669026 | 80260 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 405 | 9 | 3 | 4 | 4.3 | CC(C)C/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21513 | 80260 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 405 | 9 | 3 | 4 | 4.3 | CC(C)C/N=C(/NC#N)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
10024143 | 74290 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 403 | 9 | 2 | 3 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20300 | 74290 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 403 | 9 | 2 | 3 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
11683470 | 77010 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL208543 | 77010 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
5312142 | 77852 | 8 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL210602 | 77852 | 8 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44385826 | 60066 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CC/C=C/CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL174835 | 60066 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CC/C=C/CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44386126 | 98171 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 372 | 13 | 1 | 4 | 5.2 | CCCCSCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL277056 | 98171 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 372 | 13 | 1 | 4 | 5.2 | CCCCSCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44387119 | 128959 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 330 | 10 | 1 | 4 | 4.0 | CSCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL367261 | 128959 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 330 | 10 | 1 | 4 | 4.0 | CSCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
10543197 | 21057 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
CHEMBL131334 | 21057 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
10518243 | 20727 | 1 | None | - | 1 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cccnn1 | 10.1021/jm960341g | ||
CHEMBL131088 | 20727 | 1 | None | - | 1 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cccnn1 | 10.1021/jm960341g | ||
10756559 | 116158 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
CHEMBL337048 | 116158 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 299 | 8 | 1 | 5 | 2.5 | O=C(O)CCCCO/N=C(/c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
44387045 | 165657 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 369 | 12 | 2 | 4 | 3.2 | CCCNC(=O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL426586 | 165657 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 369 | 12 | 2 | 4 | 3.2 | CCCNC(=O)CSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
18921515 | 14494 | 0 | None | -141 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205659 | 14494 | 0 | None | -141 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL130170 | 14494 | 0 | None | -141 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 407 | 8 | 2 | 3 | 3.4 | O=C(O)Cc1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740443 | 90917 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402428 | 90917 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
16757483 | 143395 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
CHEMBL390217 | 143395 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 427 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(Cl)c1 | 10.1021/jm070427h | ||
16757177 | 144212 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 11 | 2 | 7 | 4.0 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCC)cc1 | 10.1021/jm070427h | ||
CHEMBL390897 | 144212 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 11 | 2 | 7 | 4.0 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OCC)cc1 | 10.1021/jm070427h | ||
71740184 | 90915 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402426 | 90915 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 387 | 4 | 2 | 5 | 3.4 | Cc1ccc(Oc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44273500 | 76269 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 373 | 8 | 2 | 3 | 3.0 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
CHEMBL20635 | 76269 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 373 | 8 | 2 | 3 | 3.0 | O=C(O)CC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(F)cc2)CC[C@H]1F | 10.1016/0960-894X(95)00199-4 | ||
11662021 | 139023 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
CHEMBL379659 | 139023 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
10670440 | 80095 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 433 | 9 | 3 | 4 | 5.2 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21476 | 80095 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 433 | 9 | 3 | 4 | 5.2 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCCCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
71451008 | 79307 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)C[S@@+]([O-])[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL2115559 | 79307 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 489 | 11 | 1 | 4 | 6.0 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)C[S@@+]([O-])[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
3356 | 2248 | 68 | None | -977 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
4326 | 2248 | 68 | None | -977 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
9867642 | 2248 | 68 | None | -977 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
CHEMBL426559 | 2248 | 68 | None | -977 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
DB11629 | 2248 | 68 | None | -977 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
10591274 | 115598 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
CHEMBL335717 | 115598 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1ccnnc1 | 10.1021/jm960341g | ||
18921514 | 14634 | 0 | None | -117 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207018 | 14634 | 0 | None | -117 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL336352 | 14634 | 0 | None | -117 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 379 | 6 | 2 | 3 | 3.1 | O=C(O)c1ccc2c(c1)CC(CCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
44353308 | 14638 | 0 | None | -54 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207038 | 14638 | 0 | None | -54 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL340073 | 14638 | 0 | None | -54 | 2 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 339 | 9 | 2 | 3 | 2.1 | CCCCCS(=O)(=O)NCC1Cc2ccc(CC(=O)O)cc2C1 | 10.1016/s0960-894x(99)00014-1 | ||
71740667 | 90905 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 2.8 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402416 | 90905 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 2.8 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740557 | 90919 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402430 | 90919 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 400 | 8 | 3 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccccc1C | 10.1016/j.ejmech.2013.04.033 | ||
44305550 | 201726 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CO[C@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL65622 | 201726 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CO[C@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
54758053 | 65118 | 0 | None | 8 | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1829801 | 65118 | 0 | None | 8 | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
123879 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1910 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1911 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
2354 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
CHEMBL361812 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
DB13036 | 3235 | 77 | None | 1 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
11597294 | 165623 | 4 | None | -33 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
CHEMBL426387 | 165623 | 4 | None | -33 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
11568248 | 138126 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
CHEMBL377679 | 138126 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
11633215 | 139625 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL380274 | 139625 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
44305343 | 100215 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
CHEMBL292331 | 100215 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 473 | 11 | 1 | 4 | 6.9 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CS[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80103-7 | ||
10548488 | 77881 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 391 | 6 | 3 | 4 | 4.0 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21072 | 77881 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 391 | 6 | 3 | 4 | 4.0 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C\CCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
11604299 | 139052 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL379736 | 139052 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
71740667 | 90905 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 2.8 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402416 | 90905 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 2.8 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Nc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44305824 | 100529 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL294353 | 100529 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
10552843 | 82792 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 483 | 8 | 3 | 4 | 5.6 | N#CN/C(=N/C12CC3CC(CC(C3)C1)C2)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
CHEMBL21852 | 82792 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 483 | 8 | 3 | 4 | 5.6 | N#CN/C(=N/C12CC3CC(CC(C3)C1)C2)Nc1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1021/jm9707941 | ||
10741449 | 78492 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 9 | 3 | 6 | 4.3 | CC(C)(C)Nc1c(Nc2cccc(/C(=C\CCCC(=O)O)c3cccnc3)c2)c(=O)c1=O | 10.1021/jm9707941 | ||
CHEMBL2112933 | 78492 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 9 | 3 | 6 | 4.3 | CC(C)(C)Nc1c(Nc2cccc(/C(=C\CCCC(=O)O)c3cccnc3)c2)c(=O)c1=O | 10.1021/jm9707941 | ||
118718127 | 114777 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CC[C@@H](O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL3349042 | 114777 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CC[C@@H](O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
11408533 | 140796 | 0 | None | -2089 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL383484 | 140796 | 0 | None | -2089 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
11408533 | 140796 | 0 | None | -2089 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL383484 | 140796 | 0 | None | -2089 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
16756979 | 91884 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL242904 | 91884 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1021/jm070427h | ||
71740310 | 90935 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402575 | 90935 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
15290043 | 14633 | 0 | None | 33 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207012 | 14633 | 0 | None | 33 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL335043 | 14633 | 0 | None | 33 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 351 | 6 | 2 | 4 | 2.1 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccs1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
18921516 | 14637 | 0 | None | 77 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1207036 | 14637 | 0 | None | 77 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL339994 | 14637 | 0 | None | 77 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 393 | 7 | 2 | 3 | 3.5 | O=C(O)c1ccc2c(c1)CC(CCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740562 | 90924 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402435 | 90924 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 386 | 4 | 3 | 5 | 3.4 | Cc1ccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740439 | 90901 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 465 | 8 | 2 | 5 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402412 | 90901 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 465 | 8 | 2 | 5 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
44291594 | 14449 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 509 | 10 | 2 | 4 | 6.0 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1205044 | 14449 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 509 | 10 | 2 | 4 | 6.0 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL46338 | 14449 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 509 | 10 | 2 | 4 | 6.0 | CC(C)c1ccc2c(CCCCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44291637 | 14709 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 481 | 8 | 2 | 4 | 5.2 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1207689 | 14709 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 481 | 8 | 2 | 4 | 5.2 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL430569 | 14709 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 481 | 8 | 2 | 4 | 5.2 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44386253 | 60109 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 386 | 11 | 1 | 3 | 5.4 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSC/C=C/c1ccccc1 | 10.1021/jm00125a009 | ||
CHEMBL175178 | 60109 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 386 | 11 | 1 | 3 | 5.4 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1CSC/C=C/c1ccccc1 | 10.1021/jm00125a009 | ||
71740312 | 90937 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 421 | 8 | 2 | 5 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402577 | 90937 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 421 | 8 | 2 | 5 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740056 | 90908 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402419 | 90908 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 373 | 5 | 2 | 5 | 3.1 | Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C | 10.1016/j.ejmech.2013.04.033 | ||
44291863 | 14451 | 0 | None | - | 1 | Rat | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 447 | 8 | 2 | 4 | 4.5 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL1205050 | 14451 | 0 | None | - | 1 | Rat | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 447 | 8 | 2 | 4 | 4.5 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL47510 | 14451 | 0 | None | - | 1 | Rat | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 447 | 8 | 2 | 4 | 4.5 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccccc3)cc(S(=O)(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
44291496 | 168191 | 0 | None | - | 1 | Rat | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 425 | 9 | 2 | 3 | 5.4 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL43726 | 168191 | 0 | None | - | 1 | Rat | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 425 | 9 | 2 | 3 | 5.4 | CC(C)c1ccc2c(CCCCS(=O)(=O)Nc3ccccc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
16757484 | 92617 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
CHEMBL244188 | 92617 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
71740312 | 90937 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 421 | 8 | 2 | 5 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402577 | 90937 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 421 | 8 | 2 | 5 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757487 | 92815 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 8 | 2 | 7 | 4.0 | CCCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL244819 | 92815 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 8 | 2 | 7 | 4.0 | CCCOc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm070427h | ||
16756877 | 91754 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)C | 10.1021/jm070427h | ||
CHEMBL242478 | 91754 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccccc1Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)C | 10.1021/jm070427h | ||
16756979 | 91884 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1021/jm070427h | ||
CHEMBL242904 | 91884 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 393 | 6 | 2 | 6 | 3.1 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)C)cc1 | 10.1021/jm070427h | ||
44305538 | 101666 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL302457 | 101666 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
10686657 | 19816 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
CHEMBL130341 | 19816 | 1 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 313 | 9 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(/c1ccccc1)c1cncnc1 | 10.1021/jm960341g | ||
16757485 | 92749 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
CHEMBL244401 | 92749 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 533 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
118714500 | 114009 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 346 | 3 | 1 | 2 | 5.3 | Cc1cccc(C)c1C1=C(O)CC(Cc2cccc3c2CCCC3)C1=O | 10.1021/ml5002085 | ||
CHEMBL3335481 | 114009 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 346 | 3 | 1 | 2 | 5.3 | Cc1cccc(C)c1C1=C(O)CC(Cc2cccc3c2CCCC3)C1=O | 10.1021/ml5002085 | ||
71138378 | 114011 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 487 | 8 | 2 | 4 | 5.4 | O=C1C(C2CCCCC2)=C(O)CC1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
CHEMBL3335483 | 114011 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 487 | 8 | 2 | 4 | 5.4 | O=C1C(C2CCCCC2)=C(O)CC1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml5002085 | ||
CHEMBL1829808 | 65125 | 0 | None | 18 | 2 | Mouse | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 433 | 8 | 2 | 4 | 4.2 | CCC1=C(O)CC(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1=O | 10.1021/jm200980u | ||
123879 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1910 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1911 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
2354 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
CHEMBL361812 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
DB13036 | 3235 | 77 | None | 1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
11661725 | 77506 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
CHEMBL209306 | 77506 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
71740185 | 90916 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402427 | 90916 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 401 | 8 | 2 | 5 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(C)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
11647396 | 77429 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL209168 | 77429 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
44304640 | 201141 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 437 | 7 | 3 | 3 | 5.7 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
CHEMBL62410 | 201141 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 437 | 7 | 3 | 3 | 5.7 | O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=N/NC(=O)Nc3ccc(Cl)c(Cl)c3)CC[C@@H]2C1 | 10.1016/S0960-894X(01)80876-3 | ||
54758054 | 65119 | 0 | None | 4 | 2 | Mouse | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
CHEMBL1829802 | 65119 | 0 | None | 4 | 2 | Mouse | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
44291693 | 180965 | 0 | None | - | 1 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 445 | 8 | 2 | 3 | 5.6 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
CHEMBL47658 | 180965 | 0 | None | - | 1 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 445 | 8 | 2 | 3 | 5.6 | CC(C)c1ccc2c(CCCS(=O)(=O)Nc3ccc(Cl)cc3)cc(C(=O)O)c-2cc1 | 10.1016/S0960-894X(00)80043-8 | ||
71740558 | 90920 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402431 | 90920 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
71740313 | 90899 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 437 | 5 | 2 | 5 | 3.5 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402410 | 90899 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 437 | 5 | 2 | 5 | 3.5 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
11697902 | 77948 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL211008 | 77948 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
71740307 | 90926 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 377 | 5 | 2 | 5 | 2.9 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402437 | 90926 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 377 | 5 | 2 | 5 | 2.9 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740309 | 90928 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 405 | 8 | 2 | 5 | 3.7 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402439 | 90928 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 405 | 8 | 2 | 5 | 3.7 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740310 | 90935 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 393 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402575 | 90935 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 393 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Cl)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740313 | 90899 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 437 | 5 | 2 | 5 | 3.5 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402410 | 90899 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 437 | 5 | 2 | 5 | 3.5 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740440 | 90902 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 485 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402413 | 90902 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 485 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740442 | 90904 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 513 | 8 | 2 | 5 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402415 | 90904 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 513 | 8 | 2 | 5 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
16757082 | 92619 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
CHEMBL244190 | 92619 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 519 | 5 | 2 | 6 | 3.8 | CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(I)c1 | 10.1021/jm070427h | ||
10409713 | 14500 | 0 | None | -42 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205668 | 14500 | 0 | None | -42 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131497 | 14500 | 0 | None | -42 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 395 | 6 | 2 | 3 | 3.2 | O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1ccc3ccccc3c1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
71740558 | 90920 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402431 | 90920 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 372 | 5 | 3 | 5 | 3.0 | Cc1cccc(Nc2ccc(C#N)cc2S(=O)(=O)NC(=O)NC(C)C)c1 | 10.1016/j.ejmech.2013.04.033 | ||
71740440 | 90902 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 485 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402413 | 90902 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 485 | 5 | 2 | 5 | 3.4 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740442 | 90904 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 513 | 8 | 2 | 5 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402415 | 90904 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 513 | 8 | 2 | 5 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(I)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740309 | 90928 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 405 | 8 | 2 | 5 | 3.7 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402439 | 90928 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 405 | 8 | 2 | 5 | 3.7 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740439 | 90901 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 465 | 8 | 2 | 5 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402412 | 90901 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 465 | 8 | 2 | 5 | 4.3 | CCCCCNC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(Br)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
71740307 | 90926 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 377 | 5 | 2 | 5 | 2.9 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
CHEMBL2402437 | 90926 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 377 | 5 | 2 | 5 | 2.9 | CC(C)NC(=O)NS(=O)(=O)c1cc(C#N)ccc1Oc1ccc(F)cc1 | 10.1016/j.ejmech.2013.04.033 | ||
18921519 | 14499 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)Cc1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL1205667 | 14499 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)Cc1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
CHEMBL131336 | 14499 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 421 | 9 | 2 | 3 | 3.8 | O=C(O)Cc1ccc2c(c1)CC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1016/s0960-894x(99)00014-1 | ||
16757484 | 92617 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
CHEMBL244188 | 92617 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 441 | 9 | 2 | 6 | 4.2 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)cc1 | 10.1021/jm070427h | ||
16755884 | 92886 | 15 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
CHEMBL245261 | 92886 | 15 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 423 | 6 | 2 | 7 | 3.2 | COc1cccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)c1 | 10.1021/jm070427h | ||
44353162 | 20364 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ncccn1 | 10.1021/jm960341g | ||
CHEMBL130785 | 20364 | 0 | None | - | 1 | Human | 4.0 | pIC50 | = | 4 | Functional | ChEMBL | 367 | 8 | 1 | 5 | 3.5 | O=C(O)CCCCO/N=C(\c1cccc(C(F)(F)F)c1)c1ncccn1 | 10.1021/jm960341g | ||
44305299 | 201705 | 0 | None | - | 0 | Rat | 10.8 | pKd | = | 10.8 | Functional | ChEMBL | 457 | 10 | 2 | 3 | 4.5 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2ccccc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65478 | 201705 | 0 | None | - | 0 | Rat | 10.8 | pKd | = | 10.8 | Functional | ChEMBL | 457 | 10 | 2 | 3 | 4.5 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2ccccc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
9891134 | 201195 | 3 | None | - | 0 | Rat | 10.6 | pKd | = | 10.6 | Functional | ChEMBL | 475 | 10 | 2 | 3 | 4.6 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL62666 | 201195 | 3 | None | - | 0 | Rat | 10.6 | pKd | = | 10.6 | Functional | ChEMBL | 475 | 10 | 2 | 3 | 4.6 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
19962365 | 201804 | 0 | None | - | 0 | Rat | 10.6 | pKd | = | 10.6 | Functional | ChEMBL | 501 | 11 | 2 | 5 | 4.1 | COc1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL66194 | 201804 | 0 | None | - | 0 | Rat | 10.6 | pKd | = | 10.6 | Functional | ChEMBL | 501 | 11 | 2 | 5 | 4.1 | COc1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
19962395 | 201751 | 0 | None | - | 0 | Rat | 10.4 | pKd | = | 10.4 | Functional | ChEMBL | 496 | 10 | 2 | 5 | 4.0 | N#Cc1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65780 | 201751 | 0 | None | - | 0 | Rat | 10.4 | pKd | = | 10.4 | Functional | ChEMBL | 496 | 10 | 2 | 5 | 4.0 | N#Cc1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
44305435 | 201671 | 0 | None | - | 0 | Rat | 10.2 | pKd | = | 10.2 | Functional | ChEMBL | 487 | 11 | 2 | 4 | 4.5 | COc1ccccc1Cc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(CCC(=O)O)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65167 | 201671 | 0 | None | - | 0 | Rat | 10.2 | pKd | = | 10.2 | Functional | ChEMBL | 487 | 11 | 2 | 4 | 4.5 | COc1ccccc1Cc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(CCC(=O)O)c1 | 10.1016/s0960-894x(98)00242-x | ||
44305171 | 201719 | 0 | None | - | 0 | Rat | 10.2 | pKd | = | 10.2 | Functional | ChEMBL | 535 | 11 | 2 | 5 | 3.9 | CS(=O)(=O)c1ccc(Cc2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65571 | 201719 | 0 | None | - | 0 | Rat | 10.2 | pKd | = | 10.2 | Functional | ChEMBL | 535 | 11 | 2 | 5 | 3.9 | CS(=O)(=O)c1ccc(Cc2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
44332831 | 4502 | 0 | None | - | 0 | Rat | 10.1 | pKd | = | 10.1 | Functional | ChEMBL | 495 | 10 | 2 | 5 | 4.1 | Cc1c(Cc2ccncc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL102533 | 4502 | 0 | None | - | 0 | Rat | 10.1 | pKd | = | 10.1 | Functional | ChEMBL | 495 | 10 | 2 | 5 | 4.1 | Cc1c(Cc2ccncc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
44305385 | 101769 | 0 | None | - | 0 | Rat | 10.1 | pKd | = | 10.1 | Functional | ChEMBL | 475 | 10 | 2 | 3 | 4.6 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2cccc(F)c2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL303097 | 101769 | 0 | None | - | 0 | Rat | 10.1 | pKd | = | 10.1 | Functional | ChEMBL | 475 | 10 | 2 | 3 | 4.6 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2cccc(F)c2)c1 | 10.1016/s0960-894x(98)00242-x | ||
19962368 | 201672 | 0 | None | - | 0 | Rat | 10.0 | pKd | = | 10 | Functional | ChEMBL | 489 | 10 | 2 | 4 | 4.2 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(C(=O)c2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65175 | 201672 | 0 | None | - | 0 | Rat | 10.0 | pKd | = | 10 | Functional | ChEMBL | 489 | 10 | 2 | 4 | 4.2 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(C(=O)c2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
18926588 | 168252 | 0 | None | - | 0 | Rat | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 482 | 9 | 2 | 5 | 4.7 | COc1ccc(S(=O)(=O)Nc2ccc3c(c2)c(Cc2ccc(F)cc2)cn3CCC(=O)O)cc1 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL43770 | 168252 | 0 | None | - | 0 | Rat | 9.8 | pKd | = | 9.8 | Functional | ChEMBL | 482 | 9 | 2 | 5 | 4.7 | COc1ccc(S(=O)(=O)Nc2ccc3c(c2)c(Cc2ccc(F)cc2)cn3CCC(=O)O)cc1 | 10.1016/0960-894X(96)00299-5 | ||
19962351 | 201750 | 0 | None | - | 0 | Rat | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 491 | 10 | 3 | 4 | 4.1 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(C(O)c2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65779 | 201750 | 0 | None | - | 0 | Rat | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 491 | 10 | 3 | 4 | 4.1 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(C(O)c2ccc(F)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
18926534 | 168255 | 0 | None | - | 0 | Rat | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 486 | 8 | 2 | 4 | 5.3 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL43772 | 168255 | 0 | None | - | 0 | Rat | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 486 | 8 | 2 | 4 | 5.3 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
18926517 | 178781 | 0 | None | - | 0 | Rat | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 466 | 8 | 2 | 4 | 5.0 | Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)c(Cc2ccc(F)cc2)cn3CCC(=O)O)cc1 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL47372 | 178781 | 0 | None | - | 0 | Rat | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 466 | 8 | 2 | 4 | 5.0 | Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)c(Cc2ccc(F)cc2)cn3CCC(=O)O)cc1 | 10.1016/0960-894X(96)00299-5 | ||
10367276 | 96175 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 466 | 8 | 2 | 5 | 4.2 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3cnccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL263442 | 96175 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 466 | 8 | 2 | 5 | 4.2 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3cnccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
19962400 | 201649 | 0 | None | - | 0 | Rat | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 549 | 11 | 2 | 6 | 3.5 | CS(=O)(=O)c1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL64971 | 201649 | 0 | None | - | 0 | Rat | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 549 | 11 | 2 | 6 | 3.5 | CS(=O)(=O)c1ccc(C(=O)c2cc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc(CCC(=O)O)c2)cc1 | 10.1016/s0960-894x(98)00242-x | ||
6604763 | 101346 | 12 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 402 | 7 | 2 | 4 | 5.3 | O=C(O)CC/C=C\C[C@@H]1CO[C@H](c2ccccc2Cl)O[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL30024 | 101346 | 12 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 402 | 7 | 2 | 4 | 5.3 | O=C(O)CC/C=C\C[C@@H]1CO[C@H](c2ccccc2Cl)O[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
44294109 | 187133 | 0 | None | - | 0 | Rat | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1C2CCC(O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00168a032 | ||
CHEMBL49535 | 187133 | 0 | None | - | 0 | Rat | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1C2CCC(O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00168a032 | ||
10321942 | 201292 | 0 | None | - | 0 | Rat | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 458 | 10 | 2 | 4 | 3.9 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2cccnc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL63090 | 201292 | 0 | None | - | 0 | Rat | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 458 | 10 | 2 | 4 | 3.9 | O=C(O)CCc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc(Cc2cccnc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
18926553 | 183330 | 0 | None | - | 0 | Rat | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 470 | 8 | 2 | 4 | 4.8 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL48128 | 183330 | 0 | None | - | 0 | Rat | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 470 | 8 | 2 | 4 | 4.8 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
44294109 | 187133 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1C2CCC(O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00168a032 | ||
CHEMBL49535 | 187133 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1C2CCC(O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00168a032 | ||
44374902 | 54524 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 579 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL161253 | 54524 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 579 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
9830229 | 55914 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 604 | 11 | 2 | 4 | 5.6 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL162641 | 55914 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 604 | 11 | 2 | 4 | 5.6 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
18926545 | 171081 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.6 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccccc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL44660 | 171081 | 0 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.6 | O=C(O)CCn1cc(Cc2ccc(F)cc2)c2cc(NS(=O)(=O)c3ccccc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
10323516 | 108074 | 1 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 495 | 10 | 2 | 5 | 4.1 | Cc1c(Cc2cccnc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL320235 | 108074 | 1 | None | - | 0 | Rat | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 495 | 10 | 2 | 5 | 4.1 | Cc1c(Cc2cccnc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
44344654 | 10421 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 449 | 8 | 2 | 4 | 4.3 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL116852 | 10421 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 449 | 8 | 2 | 4 | 4.3 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
15684002 | 119357 | 0 | None | - | 0 | Rat | 9.0 | pKd | = | 9 | Functional | ChEMBL | 576 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL348790 | 119357 | 0 | None | - | 0 | Rat | 9.0 | pKd | = | 9 | Functional | ChEMBL | 576 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15024087 | 119705 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL352040 | 119705 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
131717 | 201698 | 4 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL65414 | 201698 | 4 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
10321666 | 180623 | 0 | None | - | 0 | Rat | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 453 | 8 | 2 | 5 | 4.0 | O=C(O)CCn1cc(Cc2cccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL47612 | 180623 | 0 | None | - | 0 | Rat | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 453 | 8 | 2 | 5 | 4.0 | O=C(O)CCn1cc(Cc2cccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
44344840 | 10146 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 465 | 8 | 2 | 4 | 4.8 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3ccccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL116088 | 10146 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 465 | 8 | 2 | 4 | 4.8 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3ccccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
10005561 | 167565 | 1 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 484 | 10 | 2 | 6 | 3.3 | Cc1c(Cn2ccnc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL432958 | 167565 | 1 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 484 | 10 | 2 | 6 | 3.3 | Cc1c(Cn2ccnc2)c2cc(CCC(=O)O)ccc2n1CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
44374886 | 52819 | 0 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 565 | 10 | 2 | 6 | 3.1 | O=C(O)CO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159775 | 52819 | 0 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 565 | 10 | 2 | 6 | 3.1 | O=C(O)CO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374517 | 54358 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161108 | 54358 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
10546960 | 201664 | 0 | None | - | 2 | Rat | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
CHEMBL65121 | 201664 | 0 | None | - | 2 | Rat | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/s0960-894x(98)00242-x | ||
44374837 | 53049 | 0 | None | - | 0 | Rat | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 607 | 11 | 2 | 6 | 4.2 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=N\OCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159979 | 53049 | 0 | None | - | 0 | Rat | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 607 | 11 | 2 | 6 | 4.2 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=N\OCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374461 | 54520 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 521 | 13 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CCO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161252 | 54520 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 521 | 13 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CCO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44293931 | 101466 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
CHEMBL301098 | 101466 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
44293931 | 101466 | 0 | None | - | 1 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
CHEMBL301098 | 101466 | 0 | None | - | 1 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 384 | 10 | 2 | 3 | 4.7 | C[C@@H](c1ccccc1)[C@H](O)/C=C/C1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00168a032 | ||
44374917 | 54651 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 590 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL161422 | 54651 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 590 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15024089 | 51615 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 534 | 14 | 1 | 5 | 6.8 | CCCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL158576 | 51615 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 534 | 14 | 1 | 5 | 6.8 | CCCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024087 | 119705 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL352040 | 119705 | 0 | None | - | 0 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
13560651 | 54655 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161427 | 54655 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374532 | 119565 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350642 | 119565 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
15024095 | 55933 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162691 | 55933 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
19104271 | 172106 | 0 | None | - | 0 | Rat | 7.0 | pKd | = | 7 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 3.5 | O=C(O)CCCc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL44998 | 172106 | 0 | None | - | 0 | Rat | 7.0 | pKd | = | 7 | Functional | ChEMBL | 353 | 7 | 2 | 3 | 3.5 | O=C(O)CCCc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 | 10.1016/0960-894X(96)00299-5 | ||
44374902 | 54524 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 579 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL161253 | 54524 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 579 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374454 | 119403 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL349223 | 119403 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15684009 | 56274 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL164109 | 56274 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81051-9 | ||
44375168 | 164317 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 464 | 12 | 2 | 4 | 4.7 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL422017 | 164317 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 464 | 12 | 2 | 4 | 4.7 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374454 | 119403 | 0 | None | - | 0 | Rat | 6.0 | pKd | = | 6 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL349223 | 119403 | 0 | None | - | 0 | Rat | 6.0 | pKd | = | 6 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44387031 | 60169 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 496 | 8 | 1 | 4 | 6.3 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCC#Cc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL175538 | 60169 | 0 | None | - | 0 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 496 | 8 | 1 | 4 | 6.3 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCC#Cc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
44326663 | 108111 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 851 | 21 | 3 | 10 | 9.3 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)NCCCCCCNC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL320461 | 108111 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 851 | 21 | 3 | 10 | 9.3 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)NCCCCCCNC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
10010816 | 108146 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 854 | 16 | 1 | 11 | 10.8 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccccc3OC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccccc4Cl)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL320682 | 108146 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 854 | 16 | 1 | 11 | 10.8 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccccc3OC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccccc4Cl)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
44326662 | 111056 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 853 | 21 | 1 | 12 | 10.1 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)OCCCCCCOC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL327992 | 111056 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 853 | 21 | 1 | 12 | 10.1 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)OCCCCCCOC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
44326473 | 205753 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 795 | 17 | 3 | 10 | 7.7 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)NCCNC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL94375 | 205753 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 795 | 17 | 3 | 10 | 7.7 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)NCCNC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
10259965 | 205754 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 845 | 16 | 1 | 12 | 10.0 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccccc3OC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL94381 | 205754 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 845 | 16 | 1 | 12 | 10.0 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccccc3OC(=O)CC/C=C\C[C@@H]3CO[C@H](c4ccc(C#N)cc4)O[C@@H]3c3ccccc3O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
44326472 | 205805 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 845 | 16 | 1 | 12 | 10.0 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccc(OC(=O)CC/C=C\C[C@@H]4CO[C@H](c5ccc(C#N)cc5)O[C@@H]4c4ccccc4O)cc3)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL94692 | 205805 | 0 | None | - | 0 | Human | 5.0 | pKd | = | 5 | Functional | ChEMBL | 845 | 16 | 1 | 12 | 10.0 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)Oc3ccc(OC(=O)CC/C=C\C[C@@H]4CO[C@H](c5ccc(C#N)cc5)O[C@@H]4c4ccccc4O)cc3)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
10601707 | 43859 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 507 | 11 | 2 | 5 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)N[C@@H]3C[C@H]3c3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL151519 | 43859 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 507 | 11 | 2 | 5 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)N[C@@H]3C[C@H]3c3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
10768214 | 42616 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 517 | 13 | 2 | 6 | 5.9 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL150289 | 42616 | 0 | None | - | 0 | Human | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 517 | 13 | 2 | 6 | 5.9 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
10840154 | 43537 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 539 | 14 | 2 | 6 | 6.2 | COc1ccc(CCCNC(=O)c2coc(-c3ccc(/C(=C\CCCCC(=O)O)c4cccnc4)cc3)n2)cc1 | 10.1021/jm980173n | ||
CHEMBL151091 | 43537 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 539 | 14 | 2 | 6 | 6.2 | COc1ccc(CCCNC(=O)c2coc(-c3ccc(/C(=C\CCCCC(=O)O)c4cccnc4)cc3)n2)cc1 | 10.1021/jm980173n | ||
44344874 | 162807 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 449 | 8 | 2 | 4 | 4.3 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2)C[C@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL419224 | 162807 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 449 | 8 | 2 | 4 | 4.3 | O=C(O)CC/C=C\C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2)C[C@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
44374860 | 56195 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 593 | 12 | 2 | 6 | 3.8 | O=C(O)CCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL163276 | 56195 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 593 | 12 | 2 | 6 | 3.8 | O=C(O)CCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374518 | 52312 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159275 | 52312 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024091 | 52832 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159787 | 52832 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374517 | 54358 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161108 | 54358 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374723 | 54892 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161746 | 54892 | 0 | None | - | 0 | Rat | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374699 | 52311 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159272 | 52311 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374525 | 119632 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1cccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)c1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL351252 | 119632 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1cccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)c1 | 10.1016/S0960-894X(01)81049-0 | ||
15024085 | 167703 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL433884 | 167703 | 0 | None | - | 0 | Human | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
10626384 | 120678 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 545 | 14 | 2 | 6 | 6.5 | COC1CCC(CCCNC(=O)c2coc(-c3ccc(/C(=C\CCCCC(=O)O)c4cccnc4)cc3)n2)CC1 | 10.1021/jm980173n | ||
CHEMBL357723 | 120678 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 545 | 14 | 2 | 6 | 6.5 | COC1CCC(CCCNC(=O)c2coc(-c3ccc(/C(=C\CCCCC(=O)O)c4cccnc4)cc3)n2)CC1 | 10.1021/jm980173n | ||
44375168 | 164317 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 464 | 12 | 2 | 4 | 4.7 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL422017 | 164317 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 464 | 12 | 2 | 4 | 4.7 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374600 | 53161 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL160091 | 53161 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
5362391 | 98639 | 21 | None | - | 1 | Rat | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Rat | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81051-9 | ||
5362391 | 98639 | 21 | None | - | 1 | Rat | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Rat | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81050-7 | ||
10091054 | 206169 | 0 | None | - | 0 | Human | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 4.2 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL96727 | 206169 | 0 | None | - | 0 | Human | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 4.2 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cccnc3)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
15462462 | 196585 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 481 | 11 | 2 | 5 | 5.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL57576 | 196585 | 0 | None | - | 0 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 481 | 11 | 2 | 5 | 5.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
44333075 | 4525 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 484 | 10 | 2 | 6 | 3.3 | Cc1c(Cn2ccnc2)n(CCNS(=O)(=O)c2ccc(F)cc2)c2ccc(CCC(=O)O)cc12 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL102692 | 4525 | 0 | None | - | 0 | Rat | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 484 | 10 | 2 | 6 | 3.3 | Cc1c(Cn2ccnc2)n(CCNS(=O)(=O)c2ccc(F)cc2)c2ccc(CCC(=O)O)cc12 | 10.1016/0960-894X(95)00529-4 | ||
10790792 | 120780 | 0 | None | - | 0 | Human | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 477 | 14 | 2 | 6 | 5.0 | CCOCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
CHEMBL358012 | 120780 | 0 | None | - | 0 | Human | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 477 | 14 | 2 | 6 | 5.0 | CCOCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
6439002 | 119013 | 5 | None | - | 0 | Rat | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
CHEMBL345614 | 119013 | 5 | None | - | 0 | Rat | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
44374895 | 52446 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159447 | 52446 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374564 | 52609 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159581 | 52609 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374480 | 54625 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161360 | 54625 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
15024096 | 55335 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162133 | 55335 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374440 | 55856 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL162589 | 55856 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024098 | 119523 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL350292 | 119523 | 0 | None | - | 0 | Rat | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374564 | 52609 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159581 | 52609 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374693 | 119522 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3O)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350286 | 119522 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3O)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374439 | 119554 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350579 | 119554 | 0 | None | - | 0 | Human | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44301194 | 100097 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 461 | 13 | 2 | 5 | 5.7 | CCCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
CHEMBL291539 | 100097 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 461 | 13 | 2 | 5 | 5.7 | CCCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
11800240 | 44159 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 525 | 14 | 2 | 6 | 5.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL151860 | 44159 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 525 | 14 | 2 | 6 | 5.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
44374482 | 119375 | 0 | None | - | 0 | Rat | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL348980 | 119375 | 0 | None | - | 0 | Rat | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44385671 | 165787 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 496 | 8 | 1 | 4 | 6.3 | O=C(O)CC1CCCc2c1n(Cc1ccc(OCCCC#Cc3cccnc3)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL427300 | 165787 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 496 | 8 | 1 | 4 | 6.3 | O=C(O)CC1CCCc2c1n(Cc1ccc(OCCCC#Cc3cccnc3)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
44344856 | 14085 | 0 | None | - | 0 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 366 | 8 | 2 | 4 | 3.8 | O=C(O)CC/C=C\C[C@@H]1CN(Cc2cccnc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL119887 | 14085 | 0 | None | - | 0 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 366 | 8 | 2 | 4 | 3.8 | O=C(O)CC/C=C\C[C@@H]1CN(Cc2cccnc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
44374860 | 56195 | 0 | None | - | 0 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 593 | 12 | 2 | 6 | 3.8 | O=C(O)CCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL163276 | 56195 | 0 | None | - | 0 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 593 | 12 | 2 | 6 | 3.8 | O=C(O)CCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
5284442 | 96727 | 23 | None | - | 0 | Human | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL26820 | 96727 | 23 | None | - | 0 | Human | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81051-9 | ||
5284442 | 96727 | 23 | None | - | 0 | Human | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL26820 | 96727 | 23 | None | - | 0 | Human | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81050-7 | ||
44366545 | 167798 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 565 | 11 | 2 | 7 | 5.6 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NS(=O)(=O)c3ccc(Cl)cc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL434449 | 167798 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 565 | 11 | 2 | 7 | 5.6 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NS(=O)(=O)c3ccc(Cl)cc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
10554249 | 119195 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 531 | 14 | 2 | 6 | 6.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL347343 | 119195 | 0 | None | - | 0 | Human | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 531 | 14 | 2 | 6 | 6.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
44344859 | 110137 | 0 | None | - | 0 | Human | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 387 | 11 | 2 | 3 | 4.7 | CCCCCCC(=O)N1C[C@@H](C/C=C\CCC(=O)O)[C@@H](c2ccccc2O)C1 | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL325703 | 110137 | 0 | None | - | 0 | Human | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 387 | 11 | 2 | 3 | 4.7 | CCCCCCC(=O)N1C[C@@H](C/C=C\CCC(=O)O)[C@@H](c2ccccc2O)C1 | 10.1016/0960-894X(96)00021-2 | ||
15024097 | 52909 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159860 | 52909 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374514 | 52988 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159927 | 52988 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374473 | 54504 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161240 | 54504 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374693 | 119522 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3O)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350286 | 119522 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3O)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374724 | 119710 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL352076 | 119710 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374481 | 164240 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL421831 | 164240 | 0 | None | - | 0 | Rat | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44344858 | 10676 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 345 | 7 | 2 | 3 | 3.4 | CC(C)C(=O)N1C[C@@H](C/C=C\CCC(=O)O)[C@@H](c2ccccc2O)C1 | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL117163 | 10676 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 345 | 7 | 2 | 3 | 3.4 | CC(C)C(=O)N1C[C@@H](C/C=C\CCC(=O)O)[C@@H](c2ccccc2O)C1 | 10.1016/0960-894X(96)00021-2 | ||
44272000 | 98347 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 543 | 15 | 1 | 8 | 6.4 | CCCCCCn1cncc1[C@H]1O[C@@H](C(C)(C)Oc2ccc(C)cc2[N+](=O)[O-])OC[C@H]1C/C=C\CCC(=O)O | 10.1016/S0960-894X(00)80210-3 | ||
CHEMBL278458 | 98347 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 543 | 15 | 1 | 8 | 6.4 | CCCCCCn1cncc1[C@H]1O[C@@H](C(C)(C)Oc2ccc(C)cc2[N+](=O)[O-])OC[C@H]1C/C=C\CCC(=O)O | 10.1016/S0960-894X(00)80210-3 | ||
44374850 | 52496 | 0 | None | - | 0 | Rat | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 607 | 13 | 2 | 6 | 4.2 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159481 | 52496 | 0 | None | - | 0 | Rat | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 607 | 13 | 2 | 6 | 4.2 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15684009 | 56274 | 0 | None | - | 0 | Rat | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL164109 | 56274 | 0 | None | - | 0 | Rat | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374886 | 52819 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 565 | 10 | 2 | 6 | 3.1 | O=C(O)CO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159775 | 52819 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 565 | 10 | 2 | 6 | 3.1 | O=C(O)CO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
9830229 | 55914 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 604 | 11 | 2 | 4 | 5.6 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL162641 | 55914 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 604 | 11 | 2 | 4 | 5.6 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=C\CCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44385499 | 59357 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 510 | 9 | 1 | 4 | 6.7 | O=C(O)CC1CCCc2c1n(Cc1ccc(OCCCCC#Cc3cccnc3)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL172198 | 59357 | 0 | None | - | 0 | Human | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 510 | 9 | 1 | 4 | 6.7 | O=C(O)CC1CCCc2c1n(Cc1ccc(OCCCCC#Cc3cccnc3)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
44374850 | 52496 | 0 | None | - | 0 | Human | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 607 | 13 | 2 | 6 | 4.2 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159481 | 52496 | 0 | None | - | 0 | Human | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 607 | 13 | 2 | 6 | 4.2 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44333081 | 172314 | 0 | None | - | 0 | Rat | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 418 | 8 | 2 | 4 | 3.4 | Cc1c(C)n(CCNS(=O)(=O)c2ccc(F)cc2)c2ccc(CCC(=O)O)cc12 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL451553 | 172314 | 0 | None | - | 0 | Rat | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 418 | 8 | 2 | 4 | 3.4 | Cc1c(C)n(CCNS(=O)(=O)c2ccc(F)cc2)c2ccc(CCC(=O)O)cc12 | 10.1016/0960-894X(95)00529-4 | ||
44374724 | 119710 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL352076 | 119710 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
15024088 | 52539 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 520 | 13 | 1 | 5 | 6.4 | CCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159517 | 52539 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 520 | 13 | 1 | 5 | 6.4 | CCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024086 | 119441 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL349625 | 119441 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
18926528 | 180614 | 0 | None | - | 0 | Rat | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 378 | 6 | 2 | 4 | 3.6 | O=C(O)CCn1ccc2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL47611 | 180614 | 0 | None | - | 0 | Rat | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 378 | 6 | 2 | 4 | 3.6 | O=C(O)CCn1ccc2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
44374845 | 119673 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(F)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL351657 | 119673 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(F)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15024092 | 51961 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cncc(CO)c2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL158875 | 51961 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cncc(CO)c2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374699 | 52311 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159272 | 52311 | 0 | None | - | 0 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374600 | 53161 | 0 | None | - | 0 | Human | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL160091 | 53161 | 0 | None | - | 0 | Human | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 548 | 13 | 2 | 5 | 5.7 | CC(=O)NCc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44344788 | 113470 | 0 | None | - | 0 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 365 | 8 | 2 | 3 | 4.4 | O=C(O)CC/C=C\C[C@@H]1CN(Cc2ccccc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL332609 | 113470 | 0 | None | - | 0 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 365 | 8 | 2 | 3 | 4.4 | O=C(O)CC/C=C\C[C@@H]1CN(Cc2ccccc2)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
44386636 | 60209 | 0 | None | - | 0 | Human | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 510 | 9 | 1 | 4 | 6.7 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCC#Cc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL175801 | 60209 | 0 | None | - | 0 | Human | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 510 | 9 | 1 | 4 | 6.7 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCC#Cc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
6439002 | 119013 | 5 | None | - | 0 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
CHEMBL345614 | 119013 | 5 | None | - | 0 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
44366527 | 39397 | 0 | None | - | 0 | Human | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 531 | 15 | 3 | 4 | 6.3 | C=C(NC(=O)c1ccc(/C(=C\CCCCC(=O)O)c2cccnc2)cc1)C(=O)NCCCCC1CCCCC1 | 10.1021/jm980173n | ||
CHEMBL147444 | 39397 | 0 | None | - | 0 | Human | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 531 | 15 | 3 | 4 | 6.3 | C=C(NC(=O)c1ccc(/C(=C\CCCCC(=O)O)c2cccnc2)cc1)C(=O)NCCCCC1CCCCC1 | 10.1021/jm980173n | ||
15024094 | 54674 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 522 | 13 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CCO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL161532 | 54674 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 522 | 13 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CCO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024093 | 55672 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162409 | 55672 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024090 | 119043 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 534 | 11 | 1 | 5 | 6.8 | CC(C)(C)c1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL345876 | 119043 | 0 | None | - | 0 | Rat | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 534 | 11 | 1 | 5 | 6.8 | CC(C)(C)c1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374514 | 52988 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159927 | 52988 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 520 | 12 | 2 | 5 | 5.2 | NC(=O)c1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374473 | 54504 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161240 | 54504 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374480 | 54625 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161360 | 54625 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374487 | 119575 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350805 | 119575 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024091 | 52832 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159787 | 52832 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024094 | 54674 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 522 | 13 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CCO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL161532 | 54674 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 522 | 13 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cnccc2CCO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024096 | 55335 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162133 | 55335 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024093 | 55672 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162409 | 55672 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2CO)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024090 | 119043 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 534 | 11 | 1 | 5 | 6.8 | CC(C)(C)c1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL345876 | 119043 | 0 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 534 | 11 | 1 | 5 | 6.8 | CC(C)(C)c1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
6604763 | 101346 | 12 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 402 | 7 | 2 | 4 | 5.3 | O=C(O)CC/C=C\C[C@@H]1CO[C@H](c2ccccc2Cl)O[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL30024 | 101346 | 12 | None | - | 0 | Human | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 402 | 7 | 2 | 4 | 5.3 | O=C(O)CC/C=C\C[C@@H]1CO[C@H](c2ccccc2Cl)O[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00004-2 | ||
18926578 | 168248 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 362 | 6 | 2 | 4 | 3.1 | O=C(O)CCn1ccc2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL43768 | 168248 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 362 | 6 | 2 | 4 | 3.1 | O=C(O)CCn1ccc2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
44272014 | 98372 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 473 | 10 | 1 | 8 | 4.3 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cncn3C)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
CHEMBL278714 | 98372 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 473 | 10 | 1 | 8 | 4.3 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cncn3C)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
6439492 | 98520 | 9 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 470 | 10 | 1 | 7 | 5.0 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cccnc3)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
CHEMBL279847 | 98520 | 9 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 470 | 10 | 1 | 7 | 5.0 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cccnc3)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
44374857 | 55983 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL162879 | 55983 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374532 | 119565 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350642 | 119565 | 0 | None | - | 0 | Rat | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374711 | 119539 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350418 | 119539 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374481 | 164240 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL421831 | 164240 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
15024089 | 51615 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 534 | 14 | 1 | 5 | 6.8 | CCCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL158576 | 51615 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 534 | 14 | 1 | 5 | 6.8 | CCCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44375026 | 119245 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 436 | 10 | 2 | 4 | 3.9 | O=C(O)CC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL347812 | 119245 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 436 | 10 | 2 | 4 | 3.9 | O=C(O)CC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15024088 | 52539 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 520 | 13 | 1 | 5 | 6.4 | CCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159517 | 52539 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 520 | 13 | 1 | 5 | 6.4 | CCCc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374461 | 54520 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 521 | 13 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CCO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161252 | 54520 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 521 | 13 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CCO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
13560651 | 54655 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161427 | 54655 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024086 | 119441 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL349625 | 119441 | 0 | None | - | 0 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1ccncc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15684007 | 53000 | 0 | None | - | 0 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 518 | 11 | 2 | 4 | 5.6 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159936 | 53000 | 0 | None | - | 0 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 518 | 11 | 2 | 4 | 5.6 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374837 | 53049 | 0 | None | - | 0 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 607 | 11 | 2 | 6 | 4.2 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=N\OCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159979 | 53049 | 0 | None | - | 0 | Human | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 607 | 11 | 2 | 6 | 4.2 | CC(C)(CNS(=O)(=O)c1ccc(I)cc1)c1cccc(/C(=N\OCCC(=O)O)c2cccnc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44385778 | 59987 | 0 | None | - | 0 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 500 | 11 | 1 | 4 | 6.9 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL174388 | 59987 | 0 | None | - | 0 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 500 | 11 | 1 | 4 | 6.9 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
44386372 | 128874 | 0 | None | - | 0 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 338 | 4 | 1 | 3 | 4.1 | O=C(O)CC1CCCc2c1n(Cc1cccnc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL367109 | 128874 | 0 | None | - | 0 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 338 | 4 | 1 | 3 | 4.1 | O=C(O)CC1CCCc2c1n(Cc1cccnc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
18926585 | 172168 | 0 | None | - | 0 | Rat | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 456 | 8 | 2 | 6 | 3.6 | Cc1c(Cn2ccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2n1CCC(=O)O | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL45075 | 172168 | 0 | None | - | 0 | Rat | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 456 | 8 | 2 | 6 | 3.6 | Cc1c(Cn2ccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2n1CCC(=O)O | 10.1016/0960-894X(96)00299-5 | ||
44374561 | 119500 | 0 | None | - | 0 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350111 | 119500 | 0 | None | - | 0 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024085 | 167703 | 0 | None | - | 0 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL433884 | 167703 | 0 | None | - | 0 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cccnc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374440 | 55856 | 0 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL162589 | 55856 | 0 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81051-9 | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)81050-7 | ||
44385951 | 61782 | 0 | None | - | 0 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 484 | 10 | 1 | 3 | 7.1 | O=C(O)CC1CCCc2c1n(Cc1cccc(CCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL177596 | 61782 | 0 | None | - | 0 | Human | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 484 | 10 | 1 | 3 | 7.1 | O=C(O)CC1CCCc2c1n(Cc1cccc(CCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
10554248 | 119123 | 0 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 531 | 14 | 2 | 6 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL346644 | 119123 | 0 | None | - | 0 | Human | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 531 | 14 | 2 | 6 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1016/S0960-894X(01)80104-9 | ||
10602360 | 39305 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 533 | 14 | 2 | 7 | 5.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCC3CCCCO3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL147308 | 39305 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 533 | 14 | 2 | 7 | 5.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOCC3CCCCO3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
9869582 | 98183 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 476 | 10 | 1 | 8 | 5.1 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cncs3)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
CHEMBL277167 | 98183 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 476 | 10 | 1 | 8 | 5.1 | Cc1ccc(OC(C)(C)[C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3cncs3)O2)c([N+](=O)[O-])c1 | 10.1016/S0960-894X(00)80210-3 | ||
44374516 | 119400 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL349187 | 119400 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374561 | 119500 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350111 | 119500 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 477 | 11 | 1 | 4 | 6.1 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44326541 | 168573 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 393 | 7 | 2 | 5 | 4.5 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3ccccc3O)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
CHEMBL440321 | 168573 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 393 | 7 | 2 | 5 | 4.5 | N#Cc1ccc([C@H]2OC[C@@H](C/C=C\CCC(=O)O)[C@@H](c3ccccc3O)O2)cc1 | 10.1016/0960-894X(96)00004-2 | ||
13560651 | 54655 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161427 | 54655 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374711 | 119539 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350418 | 119539 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccc(CO)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374525 | 119632 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1cccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)c1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL351252 | 119632 | 0 | None | - | 0 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1cccc(-c2ccc(COC3CC[C@H](N4CCCCCC4)[C@H]3OC/C=C\CCC(=O)O)cc2)c1 | 10.1016/S0960-894X(01)81049-0 | ||
6439002 | 119013 | 5 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
CHEMBL345614 | 119013 | 5 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 318 | 7 | 1 | 3 | 4.3 | CC1(C)OC[C@@H](C/C=C\CCCC(=O)O)[C@@H](c2ccccc2)O1 | 10.1021/jm00384a012 | ||
44374666 | 119452 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 290 | 7 | 1 | 3 | 3.5 | O=C(O)CCC/C=C\C[C@@H]1COCO[C@@H]1c1ccccc1 | 10.1021/jm00384a012 | ||
CHEMBL349706 | 119452 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 290 | 7 | 1 | 3 | 3.5 | O=C(O)CCC/C=C\C[C@@H]1COCO[C@@H]1c1ccccc1 | 10.1021/jm00384a012 | ||
44386373 | 165432 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 486 | 10 | 1 | 4 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL425325 | 165432 | 0 | None | - | 0 | Human | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 486 | 10 | 1 | 4 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCCCc3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
10768772 | 42580 | 0 | None | - | 0 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 539 | 15 | 2 | 6 | 6.4 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL150252 | 42580 | 0 | None | - | 0 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 539 | 15 | 2 | 6 | 6.4 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
10530889 | 42521 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 559 | 15 | 2 | 6 | 6.9 | CC(OCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1)C1CCCCC1 | 10.1021/jm980173n | ||
CHEMBL150206 | 42521 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 559 | 15 | 2 | 6 | 6.9 | CC(OCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1)C1CCCCC1 | 10.1021/jm980173n | ||
44344807 | 13786 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 479 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3ccccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
CHEMBL119624 | 13786 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 479 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1CN(S(=O)(=O)c2cccc3ccccc23)C[C@@H]1c1ccccc1O | 10.1016/0960-894X(96)00021-2 | ||
18926535 | 100692 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 442 | 8 | 2 | 6 | 3.3 | O=C(O)CCn1cc(Cn2ccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
CHEMBL295512 | 100692 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 442 | 8 | 2 | 6 | 3.3 | O=C(O)CCn1cc(Cn2ccnc2)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc21 | 10.1016/0960-894X(96)00299-5 | ||
44374487 | 119575 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350805 | 119575 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3CO)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374546 | 119662 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(O)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL351563 | 119662 | 0 | None | - | 0 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(O)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
14371756 | 77974 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccccc2CO)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL2110359 | 77974 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccccc2CO)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374579 | 118985 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(CO[C@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL345396 | 118985 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(CO[C@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374546 | 119662 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(O)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL351563 | 119662 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 493 | 11 | 2 | 5 | 5.8 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccc(O)cc3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
15024092 | 51961 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cncc(CO)c2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL158875 | 51961 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 508 | 12 | 2 | 6 | 5.0 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2cncc(CO)c2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024097 | 52909 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL159860 | 52909 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 492 | 11 | 1 | 5 | 5.8 | Cc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
15024098 | 119523 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL350292 | 119523 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 506 | 12 | 1 | 5 | 6.0 | CCc1cnccc1-c1ccc(CO[C@@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44332843 | 4656 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 294 | 5 | 2 | 2 | 3.5 | Cc1[nH]c2ccc(CCC(=O)O)cc2c1Cc1ccncc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL103580 | 4656 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 294 | 5 | 2 | 2 | 3.5 | Cc1[nH]c2ccc(CCC(=O)O)cc2c1Cc1ccncc1 | 10.1016/0960-894X(95)00529-4 | ||
10601707 | 43859 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 507 | 11 | 2 | 5 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)N[C@@H]3C[C@H]3c3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL151519 | 43859 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 507 | 11 | 2 | 5 | 6.1 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)N[C@@H]3C[C@H]3c3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
15684007 | 53000 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 518 | 11 | 2 | 4 | 5.6 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159936 | 53000 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 518 | 11 | 2 | 4 | 5.6 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374550 | 52860 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 535 | 12 | 3 | 5 | 5.6 | NC(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159814 | 52860 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 535 | 12 | 3 | 5 | 5.6 | NC(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374579 | 118985 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(CO[C@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL345396 | 118985 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 570 | 13 | 2 | 6 | 5.5 | CS(=O)(=O)Nc1ccccc1-c1ccc(CO[C@H]2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374439 | 119554 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350579 | 119554 | 0 | None | - | 0 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374439 | 119554 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350579 | 119554 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374857 | 55983 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL162879 | 55983 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 495 | 12 | 2 | 6 | 4.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
15684002 | 119357 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 576 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL348790 | 119357 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 576 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44386425 | 123305 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 498 | 10 | 1 | 4 | 7.0 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCC/C=C\c3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL362418 | 123305 | 0 | None | - | 0 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 498 | 10 | 1 | 4 | 7.0 | O=C(O)CC1CCCc2c1n(Cc1cccc(OCCC/C=C\c3cccnc3)c1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
5284442 | 96727 | 23 | None | - | 0 | Rat | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL26820 | 96727 | 23 | None | - | 0 | Rat | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81051-9 | ||
5284442 | 96727 | 23 | None | - | 0 | Rat | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL26820 | 96727 | 23 | None | - | 0 | Rat | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/S0960-894X(01)81050-7 | ||
10769084 | 42776 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 553 | 16 | 2 | 6 | 6.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL150436 | 42776 | 0 | None | - | 0 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 553 | 16 | 2 | 6 | 6.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
10696954 | 42971 | 0 | None | - | 0 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 507 | 16 | 2 | 7 | 4.6 | COCCOCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
CHEMBL150598 | 42971 | 0 | None | - | 0 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 507 | 16 | 2 | 7 | 4.6 | COCCOCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1021/jm980173n | ||
44332844 | 4702 | 0 | None | - | 0 | Rat | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 481 | 10 | 2 | 5 | 3.8 | O=C(O)CCc1ccc2c(c1)c(Cc1ccncc1)cn2CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL103924 | 4702 | 0 | None | - | 0 | Rat | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 481 | 10 | 2 | 5 | 3.8 | O=C(O)CCc1ccc2c(c1)c(Cc1ccncc1)cn2CCNS(=O)(=O)c1ccc(F)cc1 | 10.1016/0960-894X(95)00529-4 | ||
44374518 | 52312 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159275 | 52312 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374550 | 52860 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 535 | 12 | 3 | 5 | 5.6 | NC(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL159814 | 52860 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 535 | 12 | 3 | 5 | 5.6 | NC(=O)Nc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
13560651 | 54655 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161427 | 54655 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44374723 | 54892 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL161746 | 54892 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 584 | 14 | 2 | 6 | 5.1 | CNS(=O)(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44374482 | 119375 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL348980 | 119375 | 0 | None | - | 0 | Human | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 534 | 13 | 2 | 5 | 5.1 | NC(=O)Cc1ccccc1-c1ccc(COC2CC[C@H](N3CCCCCC3)[C@H]2OC/C=C\CCC(=O)O)cc1 | 10.1016/S0960-894X(01)81049-0 | ||
44305522 | 201282 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL63040 | 201282 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@@H]1[C@@H](c2cccnc2)OC[C@@H]1OCc1ccc(-c2ccccc2)cc1 | 10.1016/S0960-894X(01)80104-9 | ||
44305538 | 101666 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
CHEMBL302457 | 101666 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 457 | 11 | 1 | 4 | 6.2 | O=C(O)CC/C=C\CC[C@H]1[C@H](OCc2ccc(-c3ccccc3)cc2)CO[C@@H]1c1cccnc1 | 10.1016/S0960-894X(01)80104-9 | ||
10505899 | 43526 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 511 | 13 | 2 | 6 | 5.6 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL151083 | 43526 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 511 | 13 | 2 | 6 | 5.6 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCOc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
15024095 | 55933 | 0 | None | - | 0 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
CHEMBL162691 | 55933 | 0 | None | - | 0 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 478 | 11 | 1 | 5 | 5.5 | O=C(O)CC/C=C\CO[C@@H]1[C@@H](N2CCCCCC2)CC[C@H]1OCc1ccc(-c2ccncc2)cc1 | 10.1016/S0960-894X(01)81050-7 | ||
44374516 | 119400 | 0 | None | - | 0 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL349187 | 119400 | 0 | None | - | 0 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 507 | 12 | 2 | 5 | 5.6 | O=C(O)CC/C=C\CO[C@H]1[C@@H](OCc2ccc(-c3cccc(CO)c3)cc2)CC[C@@H]1N1CCCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
10406932 | 98559 | 1 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
CHEMBL280107 | 98559 | 1 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1016/S0960-894X(00)80601-0 | ||
15462460 | 200159 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 445 | 11 | 2 | 5 | 5.0 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCC3CC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL60710 | 200159 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 445 | 11 | 2 | 5 | 5.0 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCC3CC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
44374895 | 52446 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL159447 | 52446 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374917 | 54651 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 590 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL161422 | 54651 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 590 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(I)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374845 | 119673 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(F)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL351657 | 119673 | 0 | None | - | 0 | Human | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(F)cc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
44374439 | 119554 | 0 | None | - | 0 | Rat | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
CHEMBL350579 | 119554 | 0 | None | - | 0 | Rat | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 463 | 11 | 1 | 4 | 5.7 | O=C(O)CC/C=C\CO[C@H]1C(OCc2ccc(-c3ccccc3)cc2)CC[C@@H]1N1CCCCC1 | 10.1016/S0960-894X(01)81049-0 | ||
44375026 | 119245 | 0 | None | - | 0 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 436 | 10 | 2 | 4 | 3.9 | O=C(O)CC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
CHEMBL347812 | 119245 | 0 | None | - | 0 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 436 | 10 | 2 | 4 | 3.9 | O=C(O)CC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccccc2)c1 | 10.1016/S0960-894X(01)81051-9 | ||
5362391 | 98639 | 21 | None | - | 1 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm980173n | ||
CHEMBL280728 | 98639 | 21 | None | - | 1 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm980173n | ||
51550 | 204036 | 9 | None | - | 1 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1016/0960-894X(95)00529-4 | ||
CHEMBL8273 | 204036 | 9 | None | - | 1 | Rat | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1016/0960-894X(95)00529-4 | ||
10720045 | 42926 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 495 | 12 | 2 | 5 | 5.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL150563 | 42926 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 495 | 12 | 2 | 5 | 5.8 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCc3ccccc3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
5284442 | 96727 | 23 | None | - | 0 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL26820 | 96727 | 23 | None | - | 0 | Human | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1021/jm980173n | ||
10768926 | 43048 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 545 | 15 | 2 | 6 | 6.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL150660 | 43048 | 0 | None | - | 0 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 545 | 15 | 2 | 6 | 6.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCOC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
9958626 | 101233 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
CHEMBL299467 | 101233 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1021/jm980173n | ||
52944928 | 19096 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 447 | 5 | 1 | 4 | 4.8 | C[C@@H](c1ccc(F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290414 | 19096 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 447 | 5 | 1 | 4 | 4.8 | C[C@@H](c1ccc(F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
9817405 | 164851 | 2 | None | - | 0 | Human | 5.0 | pKi | = | 5 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL423815 | 164851 | 2 | None | - | 0 | Human | 5.0 | pKi | = | 5 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
52949846 | 19113 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 507 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Br)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290523 | 19113 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 507 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Br)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
52943623 | 18791 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 6.0 | C[C@@H](c1ccc(Cl)c(Cl)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1287835 | 18791 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 6.0 | C[C@@H](c1ccc(Cl)c(Cl)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
11386109 | 19135 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 481 | 6 | 1 | 4 | 5.3 | CS(=O)(=O)c1cc(F)cc2c3c(n([C@@H](CF)c4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290639 | 19135 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 481 | 6 | 1 | 4 | 5.3 | CS(=O)(=O)c1cc(F)cc2c3c(n([C@@H](CF)c4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
11294992 | 19155 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 499 | 6 | 1 | 4 | 5.6 | CS(=O)(=O)c1cc(F)cc2c3c(n([C@H](c4ccc(Cl)cc4)C(F)F)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290755 | 19155 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 499 | 6 | 1 | 4 | 5.6 | CS(=O)(=O)c1cc(F)cc2c3c(n([C@H](c4ccc(Cl)cc4)C(F)F)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
52945002 | 19134 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 507 | 6 | 1 | 6 | 4.1 | C[C@@H](c1ccc(S(C)(=O)=O)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290638 | 19134 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 507 | 6 | 1 | 6 | 4.1 | C[C@@H](c1ccc(S(C)(=O)=O)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
10095268 | 85729 | 0 | None | -7 | 3 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 449 | 6 | 1 | 3 | 6.8 | Cc1ccc(-n2c(C)ccc2-c2cc(Cl)ccc2OCc2ccc(F)cc2)cc1C(=O)O | 10.1016/j.bmcl.2006.11.059 | ||
CHEMBL231184 | 85729 | 0 | None | -7 | 3 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 449 | 6 | 1 | 3 | 6.8 | Cc1ccc(-n2c(C)ccc2-c2cc(Cl)ccc2OCc2ccc(F)cc2)cc1C(=O)O | 10.1016/j.bmcl.2006.11.059 | ||
44390268 | 63938 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.9 | O=C(O)CCn1c2c(c3cc(NS(=O)(=O)c4ccc(F)cc4)ccc31)CCCC2 | 10.1016/j.bmcl.2004.12.055 | ||
CHEMBL180929 | 63938 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.9 | O=C(O)CCn1c2c(c3cc(NS(=O)(=O)c4ccc(F)cc4)ccc31)CCCC2 | 10.1016/j.bmcl.2004.12.055 | ||
123879 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
1910 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
1911 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
2354 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
CHEMBL361812 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
DB13036 | 3235 | 77 | None | 1 | 4 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2004.12.055 | ||
11259797 | 19038 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | C[C@@H](c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290079 | 19038 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | C[C@@H](c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
10216985 | 19024 | 0 | None | - | 0 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 449 | 5 | 1 | 4 | 4.8 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1289984 | 19024 | 0 | None | - | 0 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 449 | 5 | 1 | 4 | 4.8 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2010.10.018 | ||
21019821 | 19039 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 481 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Cl)c(F)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290080 | 19039 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 481 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Cl)c(F)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
52948543 | 19054 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 481 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Cl)cc1F)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290187 | 19054 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 481 | 5 | 1 | 4 | 5.5 | C[C@@H](c1ccc(Cl)cc1F)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
52948585 | 19072 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | C[C@@H](c1cccc(Cl)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290299 | 19072 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | C[C@@H](c1cccc(Cl)c1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
24760470 | 14570 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 334 | 4 | 1 | 4 | 4.6 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL1206294 | 14570 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 334 | 4 | 1 | 4 | 4.6 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL257997 | 14570 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 334 | 4 | 1 | 4 | 4.6 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
11488860 | 19095 | 0 | None | -7762 | 2 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290413 | 19095 | 0 | None | -7762 | 2 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
52941281 | 19071 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 429 | 5 | 1 | 4 | 4.7 | C[C@@H](c1ccccc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290298 | 19071 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 429 | 5 | 1 | 4 | 4.7 | C[C@@H](c1ccccc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
24760471 | 14675 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 317 | 4 | 1 | 3 | 4.8 | CC(C)Cc1cn(-c2ccc(C(=O)O)o2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL1207406 | 14675 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 317 | 4 | 1 | 3 | 4.8 | CC(C)Cc1cn(-c2ccc(C(=O)O)o2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL403407 | 14675 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 317 | 4 | 1 | 3 | 4.8 | CC(C)Cc1cn(-c2ccc(C(=O)O)o2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
9817292 | 56931 | 0 | None | - | 0 | Human | 5.3 | pKi | = | 5.3 | Functional | ChEMBL | 284 | 5 | 1 | 2 | 4.1 | CSc1ccc(Cc2ccccc2/C=C/C(=O)O)cc1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL165010 | 56931 | 0 | None | - | 0 | Human | 5.3 | pKi | = | 5.3 | Functional | ChEMBL | 284 | 5 | 1 | 2 | 4.1 | CSc1ccc(Cc2ccccc2/C=C/C(=O)O)cc1 | 10.1016/s0960-894x(01)00056-7 | ||
24760390 | 14564 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 378 | 4 | 1 | 4 | 4.7 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Br)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL1206284 | 14564 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 378 | 4 | 1 | 4 | 4.7 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Br)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL257134 | 14564 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 378 | 4 | 1 | 4 | 4.7 | CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Br)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
44377464 | 119580 | 0 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL350832 | 119580 | 0 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
24760322 | 14553 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 362 | 4 | 1 | 4 | 5.4 | CC(C)(C)CCc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL1206265 | 14553 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 362 | 4 | 1 | 4 | 5.4 | CC(C)(C)CCc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
CHEMBL255675 | 14553 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 362 | 4 | 1 | 4 | 5.4 | CC(C)(C)CCc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12 | 10.1016/j.bmcl.2008.03.018 | ||
10402929 | 57239 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL166351 | 57239 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
52944959 | 19114 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 454 | 5 | 1 | 5 | 4.6 | C[C@@H](c1ccc(C#N)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1290524 | 19114 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 454 | 5 | 1 | 5 | 4.6 | C[C@@H](c1ccc(C#N)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
6071 | 308 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 382 | 13 | 2 | 5 | 4.4 | CCCCC[C@@H](CC[C@H]1[C@@H]2OC(=O)O[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 8882612 | ||
73755173 | 308 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 382 | 13 | 2 | 5 | 4.4 | CCCCC[C@@H](CC[C@H]1[C@@H]2OC(=O)O[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 8882612 | ||
11968293 | 309 | 0 | None | - | 1 | Rat | 8.9 | pEC50 | = | 8.9 | Functional | Guide to Pharmacology | 366 | 12 | 2 | 5 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H]2OC(=O)O[C@H]([C@@H]1C/C=C\CCCCO)C2)O | 8882612 | ||
3387 | 309 | 0 | None | - | 1 | Rat | 8.9 | pEC50 | = | 8.9 | Functional | Guide to Pharmacology | 366 | 12 | 2 | 5 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H]2OC(=O)O[C@H]([C@@H]1C/C=C\CCCCO)C2)O | 8882612 | ||
6070 | 3603 | 0 | None | - | 1 | Rat | 9.1 | pEC50 | = | 9.1 | Functional | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.5 | CCCCC[C@@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O2)O | 4067988 | ||
73755172 | 3603 | 0 | None | - | 1 | Rat | 9.1 | pEC50 | = | 9.1 | Functional | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.5 | CCCCC[C@@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O2)O | 4067988 | ||
10341876 | 2964 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 416 | 17 | 1 | 3 | 6.8 | CCCCC/C=C\CC(C(C1CC1)[C@H](/C=C\C/C=C\CCCC(=O)OC)O)C1CC1 | 14560042 | ||
9755 | 2964 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 416 | 17 | 1 | 3 | 6.8 | CCCCC/C=C\CC(C(C1CC1)[C@H](/C=C\C/C=C\CCCC(=O)OC)O)C1CC1 | 14560042 | ||
10341876 | 2964 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 416 | 17 | 1 | 3 | 6.8 | CCCCC/C=C\CC(C(C1CC1)[C@H](/C=C\C/C=C\CCCC(=O)OC)O)C1CC1 | 14560042 | ||
9755 | 2964 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 416 | 17 | 1 | 3 | 6.8 | CCCCC/C=C\CC(C(C1CC1)[C@H](/C=C\C/C=C\CCCC(=O)OC)O)C1CC1 | 14560042 | ||
11537 | 2853 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | Guide to Pharmacology | 515 | 7 | 2 | 6 | 5.4 | N#Cc1ccc(c(c1)S(=O)(=O)NC(=O)NC(C)(C)C)Oc1cccc(c1)c1ccc(cc1)OC(F)F | None | ||
124147085 | 2853 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | Guide to Pharmacology | 515 | 7 | 2 | 6 | 5.4 | N#Cc1ccc(c(c1)S(=O)(=O)NC(=O)NC(C)(C)C)Oc1cccc(c1)c1ccc(cc1)OC(F)F | None | ||
11537 | 2853 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Guide to Pharmacology | 515 | 7 | 2 | 6 | 5.4 | N#Cc1ccc(c(c1)S(=O)(=O)NC(=O)NC(C)(C)C)Oc1cccc(c1)c1ccc(cc1)OC(F)F | None | ||
124147085 | 2853 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Guide to Pharmacology | 515 | 7 | 2 | 6 | 5.4 | N#Cc1ccc(c(c1)S(=O)(=O)NC(=O)NC(C)(C)C)Oc1cccc(c1)c1ccc(cc1)OC(F)F | None | ||
6073 | 3726 | 41 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 9871769 | ||
9938840 | 3726 | 41 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 9871769 | ||
CHEMBL2107786 | 3726 | 41 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 407 | 6 | 2 | 3 | 3.5 | OC(=O)CCc1c(C)ccc2c1CC[C@H](C2)NS(=O)(=O)c1ccc(cc1)Cl | 9871769 | ||
1939 | 3632 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 366 | 12 | 2 | 3 | 5.2 | CCCCC[C@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)S2)O | 8242228 | ||
5311453 | 3632 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 366 | 12 | 2 | 3 | 5.2 | CCCCC[C@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)S2)O | 8242228 | ||
23654676 | 1946 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 402 | 7 | 2 | 4 | 5.3 | OC(=O)CC/C=C/C[C@@H]1CO[C@@H](O[C@@H]1c1ccccc1O)c1ccccc1Cl | 8859002 | ||
6072 | 1946 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 402 | 7 | 2 | 4 | 5.3 | OC(=O)CC/C=C/C[C@@H]1CO[C@@H](O[C@@H]1c1ccccc1O)c1ccccc1Cl | 8859002 |
Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Affinity) |
# tested GPCRs (Affinity) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
44306573 | 162607 | 0 | None | - | 0 | Rat | 9.6 | pEC50 | = | 9.6 | Binding | ChEMBL | 380 | 12 | 2 | 5 | 4.2 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL417967 | 162607 | 0 | None | - | 0 | Rat | 9.6 | pEC50 | = | 9.6 | Binding | ChEMBL | 380 | 12 | 2 | 5 | 4.2 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/S0960-894X(01)80110-4 | ||
15289204 | 201401 | 0 | None | - | 0 | Rat | 9.0 | pEC50 | = | 9 | Binding | ChEMBL | 366 | 12 | 2 | 5 | 4.1 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCCO | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL63892 | 201401 | 0 | None | - | 0 | Rat | 9.0 | pEC50 | = | 9 | Binding | ChEMBL | 366 | 12 | 2 | 5 | 4.1 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCCO | 10.1016/S0960-894X(01)80110-4 | ||
44306573 | 162607 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 380 | 12 | 2 | 5 | 4.2 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL417967 | 162607 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 380 | 12 | 2 | 5 | 4.2 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/S0960-894X(01)80110-4 | ||
44306604 | 168748 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 379 | 12 | 2 | 5 | 3.6 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(N)=O | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL441620 | 168748 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 379 | 12 | 2 | 5 | 3.6 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(N)=O | 10.1016/S0960-894X(01)80110-4 | ||
44306912 | 101885 | 0 | None | - | 0 | Rat | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 421 | 13 | 2 | 5 | 4.7 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)NC(C)C | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL303777 | 101885 | 0 | None | - | 0 | Rat | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 421 | 13 | 2 | 5 | 4.7 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(=O)NC(C)C | 10.1016/S0960-894X(01)80110-4 | ||
44306604 | 168748 | 0 | None | - | 0 | Rat | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 379 | 12 | 2 | 5 | 3.6 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(N)=O | 10.1016/S0960-894X(01)80110-4 | ||
CHEMBL441620 | 168748 | 0 | None | - | 0 | Rat | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 379 | 12 | 2 | 5 | 3.6 | CCCCCC(O)/C=C/[C@H]1[C@H]2C[C@H](OC(=O)O2)[C@@H]1C/C=C\CCCC(N)=O | 10.1016/S0960-894X(01)80110-4 | ||
10717385 | 167947 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 427 | 9 | 2 | 3 | 4.7 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)[C@H]2CC[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL435382 | 167947 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 427 | 9 | 2 | 3 | 4.7 | O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)[C@H]2CC[C@@H]1C2 | 10.1021/jm970343g | ||
11647396 | 77429 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL209168 | 77429 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
11661725 | 77506 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
CHEMBL209306 | 77506 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
11656254 | 77424 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
CHEMBL209134 | 77424 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
11502680 | 97788 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL274415 | 97788 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11647396 | 77429 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL209168 | 77429 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 418 | 5 | 2 | 6 | 3.5 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)N2CCCCC2)cc1 | 10.1021/jm060108a | ||
11531590 | 77540 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL209406 | 77540 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11662021 | 139023 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
CHEMBL379659 | 139023 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
11604299 | 139052 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL379736 | 139052 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
11704760 | 77258 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL208818 | 77258 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11531590 | 77540 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL209406 | 77540 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 407 | 8 | 2 | 6 | 3.5 | CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11633215 | 139625 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL380274 | 139625 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
5312142 | 77852 | 8 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL210602 | 77852 | 8 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11661725 | 77506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
CHEMBL209306 | 77506 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 420 | 5 | 3 | 6 | 3.7 | Cc1cccc(C)c1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)NC(C)(C)C | 10.1021/jm060108a | ||
11683470 | 77010 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL208543 | 77010 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
11510008 | 76929 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
CHEMBL208115 | 76929 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
5312142 | 77852 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL210602 | 77852 | 8 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 406 | 5 | 3 | 6 | 3.4 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11604299 | 139052 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL379736 | 139052 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 426 | 10 | 3 | 6 | 3.9 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
11662021 | 139023 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
CHEMBL379659 | 139023 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(C)cc(C)c1 | 10.1021/jm060108a | ||
9866368 | 202929 | 27 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 412 | 9 | 3 | 6 | 3.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1016/s0960-894x(01)00114-7 | ||
CHEMBL7353 | 202929 | 27 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 412 | 9 | 3 | 6 | 3.5 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1016/s0960-894x(01)00114-7 | ||
11568384 | 77443 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
CHEMBL209245 | 77443 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
11567679 | 77395 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL209035 | 77395 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11568248 | 138126 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
CHEMBL377679 | 138126 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
11683470 | 77010 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
CHEMBL208543 | 77010 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 433 | 6 | 2 | 6 | 4.0 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC2CCCCC2)cc1 | 10.1021/jm060108a | ||
11568248 | 138126 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
CHEMBL377679 | 138126 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 434 | 9 | 3 | 6 | 4.1 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1c(C)cccc1C | 10.1021/jm060108a | ||
11704760 | 77258 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL208818 | 77258 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 435 | 10 | 2 | 6 | 4.3 | CCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11633215 | 139625 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL380274 | 139625 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 423 | 5 | 2 | 6 | 3.8 | Cc1ccc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11567679 | 77395 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
CHEMBL209035 | 77395 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 407 | 5 | 2 | 6 | 3.5 | Cc1ccc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NC(C)(C)C)cc1 | 10.1021/jm060108a | ||
11656254 | 77424 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
CHEMBL209134 | 77424 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 498 | 9 | 3 | 6 | 4.6 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(Br)c(C)c1 | 10.1021/jm060108a | ||
11568384 | 77443 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
CHEMBL209245 | 77443 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 440 | 7 | 3 | 6 | 3.8 | Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCc2ccccc2)cc1 | 10.1021/jm060108a | ||
44350662 | 17827 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 518 | 9 | 2 | 4 | 5.5 | O=C(O)c1cccc(/C=C(\c2ccc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc2)c2cccnc2)c1 | 10.1021/jm00027a004 | ||
CHEMBL126334 | 17827 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 518 | 9 | 2 | 4 | 5.5 | O=C(O)c1cccc(/C=C(\c2ccc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc2)c2cccnc2)c1 | 10.1021/jm00027a004 | ||
10386455 | 110786 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 11 | 1 | 5 | 4.5 | O=C(O)/C=C/CCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL326521 | 110786 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 11 | 1 | 5 | 4.5 | O=C(O)/C=C/CCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10669025 | 203347 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C/CCCC(=O)O)c2cccnc2)c1 | 10.1016/s0960-894x(01)00114-7 | ||
CHEMBL7718 | 203347 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 405 | 7 | 3 | 4 | 4.4 | CC(C)(C)/N=C(\NC#N)Nc1cccc(/C(=C/CCCC(=O)O)c2cccnc2)c1 | 10.1016/s0960-894x(01)00114-7 | ||
54592351 | 76906 | 5 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)C[C@@H]1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00108a042 | ||
CHEMBL2079673 | 76906 | 5 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)C[C@@H]1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00108a042 | ||
9983481 | 18766 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 500 | 11 | 2 | 4 | 4.2 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1ccc[n+]([O-])c1 | 10.1021/jm00027a004 | ||
CHEMBL128678 | 18766 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 500 | 11 | 2 | 4 | 4.2 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1ccc[n+]([O-])c1 | 10.1021/jm00027a004 | ||
10002804 | 161395 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 430 | 13 | 2 | 4 | 4.0 | CCCCS(=O)(=O)NCCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL415519 | 161395 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 430 | 13 | 2 | 4 | 4.0 | CCCCS(=O)(=O)NCCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1 | 10.1021/jm00027a004 | ||
10623568 | 203617 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 10 | 2 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm970343g | ||
CHEMBL79511 | 203617 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 10 | 2 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm970343g | ||
44159772 | 68050 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 535 | 9 | 1 | 4 | 6.8 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OCc1ccc(Cl)cc1 | 10.1016/j.bmcl.2011.01.024 | ||
CHEMBL1916708 | 68050 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 535 | 9 | 1 | 4 | 6.8 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OCc1ccc(Cl)cc1 | 10.1016/j.bmcl.2011.01.024 | ||
9865257 | 15408 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 391 | 11 | 1 | 5 | 4.3 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL122123 | 15408 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 391 | 11 | 1 | 5 | 4.3 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10458951 | 17796 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 508 | 11 | 2 | 6 | 4.2 | O=S(=O)(NCCc1ccc(/C(=C\CCCc2nnn[nH]2)c2cccnc2)cc1)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
CHEMBL126185 | 17796 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 508 | 11 | 2 | 6 | 4.2 | O=S(=O)(NCCc1ccc(/C(=C\CCCc2nnn[nH]2)c2cccnc2)cc1)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
10028328 | 18327 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
CHEMBL127380 | 18327 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
11753841 | 117569 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 4.2 | O=C(O)C/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL340504 | 117569 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 4.2 | O=C(O)C/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10460371 | 19209 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 556 | 14 | 2 | 5 | 5.1 | O=C(O)CCC/C=C(\c1ccc(CCN(CCC(=O)O)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL129365 | 19209 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 556 | 14 | 2 | 5 | 5.1 | O=C(O)CCC/C=C(\c1ccc(CCN(CCC(=O)O)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10340286 | 14345 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 389 | 10 | 1 | 5 | 4.1 | O=C(O)/C=C/CCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120165 | 14345 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 389 | 10 | 1 | 5 | 4.1 | O=C(O)/C=C/CCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10047870 | 17885 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 422 | 8 | 2 | 4 | 3.4 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\C(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL126654 | 17885 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 422 | 8 | 2 | 4 | 3.4 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\C(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
10320386 | 116391 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 428 | 11 | 2 | 3 | 4.7 | O=C(O)CCC/C=C(\c1ccc(CCNC(=O)Cc2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL338334 | 116391 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 428 | 11 | 2 | 3 | 4.7 | O=C(O)CCC/C=C(\c1ccc(CCNC(=O)Cc2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10767455 | 105330 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 492 | 10 | 3 | 3 | 5.7 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccccc3)[nH]c2c1 | 10.1021/jm970343g | ||
CHEMBL312697 | 105330 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 492 | 10 | 3 | 3 | 5.7 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccccc3)[nH]c2c1 | 10.1021/jm970343g | ||
10448061 | 14815 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 309 | 13 | 1 | 5 | 3.5 | CCCCCC/C(Cn1ccnc1)=N/OCCCCC(=O)O | 10.1021/jm00047a016 | ||
CHEMBL120904 | 14815 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 309 | 13 | 1 | 5 | 3.5 | CCCCCC/C(Cn1ccnc1)=N/OCCCCC(=O)O | 10.1021/jm00047a016 | ||
10369102 | 17872 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 510 | 9 | 2 | 4 | 5.3 | O=C(O)CCC/C=C(/c1cccnc1)c1ccc2c(c1)CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/jm00027a004 | ||
CHEMBL126577 | 17872 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 510 | 9 | 2 | 4 | 5.3 | O=C(O)CCC/C=C(/c1cccnc1)c1ccc2c(c1)CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2 | 10.1021/jm00027a004 | ||
44350670 | 17826 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 518 | 9 | 2 | 4 | 5.5 | O=C(O)c1ccc(/C=C(\c2ccc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc2)c2cccnc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL126333 | 17826 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 518 | 9 | 2 | 4 | 5.5 | O=C(O)c1ccc(/C=C(\c2ccc(CCNS(=O)(=O)c3ccc(Cl)cc3)cc2)c2cccnc2)cc1 | 10.1021/jm00027a004 | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
10251833 | 15031 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 12 | 0 | 6 | 5.4 | CCOC(=O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL121043 | 15031 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 12 | 0 | 6 | 5.4 | CCOC(=O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10696132 | 167561 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 11 | 2 | 5 | 6.0 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1 | 10.1021/jm970343g | ||
CHEMBL432935 | 167561 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 11 | 2 | 5 | 6.0 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1 | 10.1021/jm970343g | ||
10648014 | 203588 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 11 | 2 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 | 10.1021/jm970343g | ||
CHEMBL79260 | 203588 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 11 | 2 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 | 10.1021/jm970343g | ||
44537923 | 138656 | 3 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 457 | 6 | 2 | 8 | 1.4 | O=C(NCc1cc(Cl)ccc1-n1cnnn1)[C@@H]1CC=NN1C(=O)[C@H](O)c1ccc(F)cc1 | 10.1039/C5MD00479A | ||
CHEMBL3787587 | 138656 | 3 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 457 | 6 | 2 | 8 | 1.4 | O=C(NCc1cc(Cl)ccc1-n1cnnn1)[C@@H]1CC=NN1C(=O)[C@H](O)c1ccc(F)cc1 | 10.1039/C5MD00479A | ||
123879 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
1910 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
1911 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
2354 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
CHEMBL361812 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
DB13036 | 3235 | 77 | None | 3 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2009.06.085 | ||
10341794 | 14358 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(/C1CCCCC1)C(Cc1cccc(F)c1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120207 | 14358 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(/C1CCCCC1)C(Cc1cccc(F)c1)n1ccnc1 | 10.1021/jm00047a016 | ||
15616468 | 202567 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 372 | 8 | 1 | 3 | 4.7 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccc(F)cc2)=C(C)C1=O | 10.1021/jm00090a009 | ||
CHEMBL71222 | 202567 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 372 | 8 | 1 | 3 | 4.7 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccc(F)cc2)=C(C)C1=O | 10.1021/jm00090a009 | ||
10402603 | 15270 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 301 | 9 | 1 | 5 | 2.6 | O=C(O)CCCCO/N=C(\Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
CHEMBL121507 | 15270 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 301 | 9 | 1 | 5 | 2.6 | O=C(O)CCCCO/N=C(\Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
1986 | 1285 | 46 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00047a016 | ||
54343 | 1285 | 46 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00047a016 | ||
CHEMBL71685 | 1285 | 46 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00047a016 | ||
10552450 | 203600 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 473 | 10 | 2 | 4 | 7.1 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(/N=N/c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL79360 | 203600 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 473 | 10 | 2 | 4 | 7.1 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(/N=N/c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm970343g | ||
54592351 | 76906 | 5 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)C[C@@H]1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00108a042 | ||
CHEMBL2079673 | 76906 | 5 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)C[C@@H]1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00108a042 | ||
11545879 | 14737 | 2 | None | -125 | 3 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
CHEMBL1207973 | 14737 | 2 | None | -125 | 3 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
CHEMBL467510 | 14737 | 2 | None | -125 | 3 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
10431402 | 14373 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 405 | 12 | 1 | 5 | 4.7 | O=C(O)CCCCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120284 | 14373 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 405 | 12 | 1 | 5 | 4.7 | O=C(O)CCCCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10255332 | 19073 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 497 | 11 | 2 | 4 | 4.6 | CNC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL129030 | 19073 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 497 | 11 | 2 | 4 | 4.6 | CNC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10430550 | 11690 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 391 | 11 | 1 | 5 | 4.3 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL118184 | 11690 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 391 | 11 | 1 | 5 | 4.3 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10455115 | 14441 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccc(Cl)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120496 | 14441 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccc(Cl)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
5362391 | 98639 | 21 | None | -1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00027a004 | ||
CHEMBL280728 | 98639 | 21 | None | -1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00027a004 | ||
10671942 | 103739 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 467 | 9 | 2 | 4 | 5.5 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm970343g | ||
CHEMBL309835 | 103739 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 467 | 9 | 2 | 4 | 5.5 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm970343g | ||
10074652 | 18046 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 498 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127017 | 18046 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 498 | 12 | 2 | 4 | 5.3 | O=C(O)CCCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
6436053 | 98258 | 11 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL277689 | 98258 | 11 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
6436053 | 98258 | 11 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm058225d | ||
CHEMBL277689 | 98258 | 11 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm058225d | ||
9930816 | 116480 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 399 | 11 | 1 | 7 | 3.7 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1cnccn1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL338741 | 116480 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 399 | 11 | 1 | 7 | 3.7 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1cnccn1)n1ccnc1 | 10.1021/jm00047a016 | ||
10024132 | 12289 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 403 | 11 | 1 | 5 | 5.6 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(CC1CCCCC1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL118568 | 12289 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 403 | 11 | 1 | 5 | 5.6 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(CC1CCCCC1)n1ccnc1 | 10.1021/jm00047a016 | ||
10018213 | 15115 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 309 | 13 | 1 | 5 | 3.5 | CCCCCC/C(Cn1ccnc1)=N\OCCCCC(=O)O | 10.1021/jm00047a016 | ||
CHEMBL121306 | 15115 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 309 | 13 | 1 | 5 | 3.5 | CCCCCC/C(Cn1ccnc1)=N\OCCCCC(=O)O | 10.1021/jm00047a016 | ||
11697902 | 77948 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL211008 | 77948 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
10007859 | 165936 | 0 | None | - | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 554 | 7 | 2 | 4 | 6.7 | CC(=O)Nc1cc(C(=O)O)cc(-n2c(C)ccc2-c2cc(Br)ccc2OCc2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2006.10.078 | ||
CHEMBL427844 | 165936 | 0 | None | - | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 554 | 7 | 2 | 4 | 6.7 | CC(=O)Nc1cc(C(=O)O)cc(-n2c(C)ccc2-c2cc(Br)ccc2OCc2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2006.10.078 | ||
11502680 | 97788 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL274415 | 97788 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 9 | 2 | 6 | 3.9 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 | 10.1021/jm060108a | ||
11676121 | 77919 | 3 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL210964 | 77919 | 3 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
11697902 | 77948 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
CHEMBL211008 | 77948 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 440 | 11 | 3 | 6 | 4.3 | CCCCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 | 10.1021/jm060108a | ||
44310390 | 101674 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 368 | 9 | 2 | 3 | 5.3 | Cc1c(C)c(C=O)c(C)c(C(CCCCCC(=O)O)c2ccccc2)c1O | 10.1021/jm00090a009 | ||
CHEMBL302514 | 101674 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 368 | 9 | 2 | 3 | 5.3 | Cc1c(C)c(C=O)c(C)c(C(CCCCCC(=O)O)c2ccccc2)c1O | 10.1021/jm00090a009 | ||
6366701 | 14299 | 7 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120041 | 14299 | 7 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
44310394 | 202413 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 374 | 8 | 3 | 3 | 5.3 | Cc1c(C)c(O)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c(C)c1O | 10.1021/jm00090a009 | ||
CHEMBL70314 | 202413 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 374 | 8 | 3 | 3 | 5.3 | Cc1c(C)c(O)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c(C)c1O | 10.1021/jm00090a009 | ||
10347272 | 18452 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 540 | 11 | 1 | 5 | 6.2 | CC(C)(C)OC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127682 | 18452 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 540 | 11 | 1 | 5 | 6.2 | CC(C)(C)OC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
59179260 | 103407 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 362 | 4 | 2 | 6 | 3.9 | Nc1c(-c2ccccc2)nn(-c2nc(C(=O)O)cs2)c1-c1ccccc1 | 10.1016/j.bmcl.2013.10.065 | ||
CHEMBL3092130 | 103407 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 362 | 4 | 2 | 6 | 3.9 | Nc1c(-c2ccccc2)nn(-c2nc(C(=O)O)cs2)c1-c1ccccc1 | 10.1016/j.bmcl.2013.10.065 | ||
1610 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
3941 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
3961 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
590 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
CHEMBL191 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
DB00678 | 2315 | 89 | None | - | 4 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 422 | 8 | 2 | 6 | 4.3 | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl | 10.1021/acs.jmedchem.0c00262 | ||
44190762 | 176306 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | ||
CHEMBL461571 | 176306 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | ||
10479865 | 18453 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
CHEMBL127683 | 18453 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(CNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
10343670 | 18659 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 448 | 10 | 2 | 3 | 5.4 | O=C(O)CCC/C=C(\c1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL128104 | 18659 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 448 | 10 | 2 | 3 | 5.4 | O=C(O)CCC/C=C(\c1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10345903 | 116600 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 13 | 2 | 4 | 5.4 | O=C(O)CCCCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL339335 | 116600 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 13 | 2 | 4 | 5.4 | O=C(O)CCCCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10502508 | 14026 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3cccc4ccsc34)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL119809 | 14026 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3cccc4ccsc34)[C@@H]1C2 | 10.1021/jm970343g | ||
5362391 | 98639 | 21 | None | -1 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00047a016 | ||
CHEMBL280728 | 98639 | 21 | None | -1 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00047a016 | ||
10547489 | 162782 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 375 | 8 | 2 | 3 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL419040 | 162782 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 375 | 8 | 2 | 3 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm970343g | ||
10050347 | 15103 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 469 | 12 | 1 | 7 | 3.7 | CS(=O)(=O)c1ccc(/C(=N\OCCCCC(=O)O)C(Cc2ccccc2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
CHEMBL121289 | 15103 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 469 | 12 | 1 | 7 | 3.7 | CS(=O)(=O)c1ccc(/C(=N\OCCCCC(=O)O)C(Cc2ccccc2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
11283 | 579 | 6 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
146368333 | 579 | 6 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4643852 | 579 | 6 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
10457484 | 116896 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 11 | 2 | 5 | 3.8 | Cn1c(CCNS(=O)(=O)c2ccc(F)cc2)ccc1/C(=C\CCCC(=O)O)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL339812 | 116896 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 11 | 2 | 5 | 3.8 | Cn1c(CCNS(=O)(=O)c2ccc(F)cc2)ccc1/C(=C\CCCC(=O)O)c1cccnc1 | 10.1021/jm00027a004 | ||
10367685 | 14364 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 475 | 12 | 1 | 7 | 4.3 | CS(=O)(=O)c1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
CHEMBL120249 | 14364 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 475 | 12 | 1 | 7 | 4.3 | CS(=O)(=O)c1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
10342027 | 16271 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 419 | 11 | 1 | 5 | 5.0 | CC(C)(CCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1)CC(=O)O | 10.1021/jm00047a016 | ||
CHEMBL123307 | 16271 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 419 | 11 | 1 | 5 | 5.0 | CC(C)(CCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1)CC(=O)O | 10.1021/jm00047a016 | ||
44159530 | 68042 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 501 | 9 | 1 | 4 | 6.2 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OCc1ccccc1 | 10.1016/j.bmcl.2011.01.024 | ||
CHEMBL1916700 | 68042 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 501 | 9 | 1 | 4 | 6.2 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OCc1ccccc1 | 10.1016/j.bmcl.2011.01.024 | ||
10087973 | 112341 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 329 | 10 | 1 | 5 | 3.3 | C/C(=N\OCCCCC(=O)O)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL330837 | 112341 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 329 | 10 | 1 | 5 | 3.3 | C/C(=N\OCCCCC(=O)O)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10344641 | 15114 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 469 | 11 | 1 | 5 | 5.1 | O=C(O)CCCCO/N=C(\c1ccc(Br)cc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL121304 | 15114 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 469 | 11 | 1 | 5 | 5.1 | O=C(O)CCCCO/N=C(\c1ccc(Br)cc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
11723604 | 15119 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 321 | 10 | 1 | 5 | 3.5 | O=C(O)CCCCCO/N=C(\Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
CHEMBL121314 | 15119 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 321 | 10 | 1 | 5 | 3.5 | O=C(O)CCCCCO/N=C(\Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
10529261 | 204058 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc4oc5ccccc5c4c3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL82896 | 204058 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc4oc5ccccc5c4c3)[C@@H]1C2 | 10.1021/jm970343g | ||
11755659 | 19208 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 498 | 11 | 1 | 4 | 5.3 | CN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
CHEMBL129355 | 19208 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 498 | 11 | 1 | 4 | 5.3 | CN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
44333604 | 4509 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 337 | 13 | 2 | 3 | 4.0 | CCCCCCNC[C@H]1C2CC(CO2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm00094a017 | ||
CHEMBL102584 | 4509 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 337 | 13 | 2 | 3 | 4.0 | CCCCCCNC[C@H]1C2CC(CO2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm00094a017 | ||
10590325 | 129154 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 300 | 3 | 3 | 5 | 2.4 | O=[N+]([O-])c1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
CHEMBL367394 | 129154 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 300 | 3 | 3 | 5 | 2.4 | O=[N+]([O-])c1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
11755215 | 17858 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 487 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL126494 | 17858 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 487 | 11 | 2 | 6 | 3.5 | O=C(O)CCO/N=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10479578 | 18324 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 464 | 12 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)Cc2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127357 | 18324 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 464 | 12 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)Cc2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10072780 | 116786 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C(\c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL339568 | 116786 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C(\c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10813802 | 13677 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 459 | 8 | 2 | 3 | 6.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc4oc5ccccc5c4c3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL119550 | 13677 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 459 | 8 | 2 | 3 | 6.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc4oc5ccccc5c4c3)[C@@H]1C2 | 10.1021/jm970343g | ||
10244703 | 15116 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 307 | 9 | 1 | 5 | 3.1 | O=C(O)CCCCO/N=C(/Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
CHEMBL121307 | 15116 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 307 | 9 | 1 | 5 | 3.1 | O=C(O)CCCCO/N=C(/Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
10258317 | 18033 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 618 | 14 | 2 | 5 | 6.6 | O=C(O)CCC/C=C(\c1ccc(CCN(Cc2ccc(C(=O)O)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127008 | 18033 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 618 | 14 | 2 | 5 | 6.6 | O=C(O)CCC/C=C(\c1ccc(CCN(Cc2ccc(C(=O)O)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10075294 | 116396 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 518 | 11 | 2 | 4 | 5.3 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL338360 | 116396 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 518 | 11 | 2 | 4 | 5.3 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10023102 | 14368 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 387 | 11 | 1 | 6 | 4.5 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccco1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120259 | 14368 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 387 | 11 | 1 | 6 | 4.5 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccco1)n1ccnc1 | 10.1021/jm00047a016 | ||
10552612 | 204003 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 477 | 9 | 2 | 3 | 5.0 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C#Cc2ccccc2)cc1 | 10.1021/jm970343g | ||
CHEMBL82489 | 204003 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 477 | 9 | 2 | 3 | 5.0 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C#Cc2ccccc2)cc1 | 10.1021/jm970343g | ||
11676121 | 77919 | 3 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
CHEMBL210964 | 77919 | 3 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(C)cc1 | 10.1021/jm060108a | ||
15125130 | 202134 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 386 | 9 | 2 | 3 | 5.4 | Cc1c(C)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c(O)c(C)c1C=O | 10.1021/jm00090a009 | ||
CHEMBL68512 | 202134 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 386 | 9 | 2 | 3 | 5.4 | Cc1c(C)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c(O)c(C)c1C=O | 10.1021/jm00090a009 | ||
10251282 | 113932 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1cccc(F)c1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL333237 | 113932 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1cccc(F)c1)n1ccnc1 | 10.1021/jm00047a016 | ||
10075114 | 18451 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 511 | 11 | 1 | 4 | 4.9 | CN(C)C(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127681 | 18451 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 511 | 11 | 1 | 4 | 4.9 | CN(C)C(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10454526 | 113931 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1F)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL333236 | 113931 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 415 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1F)n1ccnc1 | 10.1021/jm00047a016 | ||
11754856 | 18998 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 479 | 10 | 3 | 5 | 2.5 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\C(=O)NCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL128973 | 18998 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 479 | 10 | 3 | 5 | 2.5 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\C(=O)NCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
10250339 | 14254 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 399 | 15 | 1 | 5 | 5.3 | CCCCCC/C(=N\OCCCCC(=O)O)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120019 | 14254 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 399 | 15 | 1 | 5 | 5.3 | CCCCCC/C(=N\OCCCCC(=O)O)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10483360 | 197549 | 21 | None | - | 4 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | ||
CHEMBL589973 | 197549 | 21 | None | - | 4 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | ||
16219283 | 120760 | 5 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2CC(CO2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm00129a030 | ||
CHEMBL357834 | 120760 | 5 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2CC(CO2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm00129a030 | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
10594576 | 10908 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 358 | 8 | 3 | 2 | 4.0 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc[nH]3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL117399 | 10908 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 358 | 8 | 3 | 2 | 4.0 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc[nH]3)[C@@H]1C2 | 10.1021/jm970343g | ||
16222207 | 7564 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 6 | 1 | 3 | 5.4 | O=C(O)Cc1cnc(C(c2ccc(F)cc2)c2ccc(F)cc2)nc1-c1cccc(F)c1 | 10.1016/j.bmcl.2010.01.092 | ||
CHEMBL1088284 | 7564 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 6 | 1 | 3 | 5.4 | O=C(O)Cc1cnc(C(c2ccc(F)cc2)c2ccc(F)cc2)nc1-c1cccc(F)c1 | 10.1016/j.bmcl.2010.01.092 | ||
9978202 | 14362 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 11 | 1 | 6 | 4.3 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccn1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120228 | 14362 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 11 | 1 | 6 | 4.3 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccn1)n1ccnc1 | 10.1021/jm00047a016 | ||
10095993 | 19260 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 464 | 11 | 2 | 4 | 4.6 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL129734 | 19260 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 464 | 11 | 2 | 4 | 4.6 | Cc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
10436457 | 19974 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 512 | 12 | 1 | 4 | 5.7 | CCN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
CHEMBL130470 | 19974 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 512 | 12 | 1 | 4 | 5.7 | CCN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
9979675 | 116438 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 11 | 2 | 4 | 4.1 | O=C(O)CCC/C=C(\CCCNS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL338546 | 116438 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 11 | 2 | 4 | 4.1 | O=C(O)CCC/C=C(\CCCNS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
44210947 | 98659 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 498 | 10 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1COCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL280890 | 98659 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 498 | 10 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1COCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
10052055 | 19252 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 510 | 13 | 2 | 6 | 4.3 | COc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1OC | 10.1021/jm00027a004 | ||
CHEMBL129635 | 19252 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 510 | 13 | 2 | 6 | 4.3 | COc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1OC | 10.1021/jm00027a004 | ||
73354171 | 92822 | 1 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@H]2CC[C@@H](O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00108a042 | ||
CHEMBL2448578 | 92822 | 1 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 387 | 10 | 4 | 4 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@H]2CC[C@@H](O2)[C@H]1CNNC(=O)Nc1ccccc1 | 10.1021/jm00108a042 | ||
10074653 | 17828 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 498 | 11 | 1 | 5 | 5.0 | COC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL126337 | 17828 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 498 | 11 | 1 | 5 | 5.0 | COC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
44364273 | 41982 | 4 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2COC(C2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm8007618 | ||
CHEMBL149724 | 41982 | 4 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2COC(C2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm8007618 | ||
6537211 | 16945 | 4 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL125519 | 16945 | 4 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 484 | 11 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(/c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10025456 | 113496 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccccc34)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL332635 | 113496 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccccc34)[C@@H]1C2 | 10.1021/jm970343g | ||
15125138 | 162919 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 386 | 9 | 2 | 3 | 5.4 | Cc1c(C)c(C=O)c(C)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c1O | 10.1021/jm00090a009 | ||
CHEMBL420002 | 162919 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 386 | 9 | 2 | 3 | 5.4 | Cc1c(C)c(C=O)c(C)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c1O | 10.1021/jm00090a009 | ||
11510008 | 76929 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
CHEMBL208115 | 76929 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 420 | 9 | 3 | 6 | 3.8 | CCCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1cccc(C)c1 | 10.1021/jm060108a | ||
10092922 | 11693 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 11 | 1 | 5 | 4.5 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL118188 | 11693 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 11 | 1 | 5 | 4.5 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10365109 | 116955 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 425 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccc(Cl)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL339877 | 116955 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 425 | 11 | 1 | 5 | 5.0 | O=C(O)CCCCO/N=C(\c1ccccc1)C(Cc1ccc(Cl)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10599289 | 14027 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 441 | 8 | 3 | 4 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4cc(O)ccc34)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL119810 | 14027 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 441 | 8 | 3 | 4 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4cc(O)ccc34)[C@@H]1C2 | 10.1021/jm970343g | ||
10409839 | 14752 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 419 | 11 | 1 | 5 | 5.0 | CC(C)(CCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1)C(=O)O | 10.1021/jm00047a016 | ||
CHEMBL120811 | 14752 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 419 | 11 | 1 | 5 | 5.0 | CC(C)(CCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1)C(=O)O | 10.1021/jm00047a016 | ||
10742144 | 59345 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 449 | 8 | 2 | 6 | 4.5 | COc1cc(CC2c3cc(O)c(O)cc3CCN2CCc2ccccc2)cc(OC)c1OC | 10.1021/jm950896w | ||
CHEMBL172163 | 59345 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 449 | 8 | 2 | 6 | 4.5 | COc1cc(CC2c3cc(O)c(O)cc3CCN2CCc2ccccc2)cc(OC)c1OC | 10.1021/jm950896w | ||
10051348 | 116448 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 492 | 11 | 2 | 4 | 5.2 | Cc1cc(C)c(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)c(C)c1 | 10.1021/jm00027a004 | ||
CHEMBL338588 | 116448 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 492 | 11 | 2 | 4 | 5.2 | Cc1cc(C)c(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)c(C)c1 | 10.1021/jm00027a004 | ||
10254162 | 162885 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.6 | O=C(O)CC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL419774 | 162885 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.6 | O=C(O)CC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10741899 | 10418 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 443 | 8 | 2 | 3 | 6.0 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(F)cc34)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL116836 | 10418 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 443 | 8 | 2 | 3 | 6.0 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(F)cc34)[C@@H]1C2 | 10.1021/jm970343g | ||
44344457 | 110024 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 467 | 10 | 1 | 4 | 5.3 | COC(=O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(-c3ccccc3)cc2)[C@H]2CC[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL325026 | 110024 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 467 | 10 | 1 | 4 | 5.3 | COC(=O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(-c3ccccc3)cc2)[C@H]2CC[C@@H]1C2 | 10.1021/jm970343g | ||
5581 | 101188 | 10 | None | -7 | 7 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm950896w | ||
CHEMBL299175 | 101188 | 10 | None | -7 | 7 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm950896w | ||
10402602 | 14907 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 301 | 9 | 1 | 5 | 2.6 | O=C(O)CCCCO/N=C(/Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
CHEMBL120947 | 14907 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 301 | 9 | 1 | 5 | 2.6 | O=C(O)CCCCO/N=C(/Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
10370098 | 17801 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 541 | 13 | 2 | 5 | 4.1 | NC(=O)CN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
CHEMBL126196 | 17801 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 541 | 13 | 2 | 5 | 4.1 | NC(=O)CN(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
10424476 | 12362 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 293 | 8 | 1 | 5 | 2.7 | O=C(O)CCCO/N=C(/Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
CHEMBL118619 | 12362 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 293 | 8 | 1 | 5 | 2.7 | O=C(O)CCCO/N=C(/Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
1938 | 1938 | 14 | None | -1 | 4 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 10.1021/jm00108a042 | ||
5311175 | 1938 | 14 | None | -1 | 4 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 10.1021/jm00108a042 | ||
CHEMBL2113346 | 1938 | 14 | None | -1 | 4 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 10.1021/jm00108a042 | ||
10096033 | 97913 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 465 | 11 | 1 | 5 | 5.9 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccc(C(F)(F)F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL275256 | 97913 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 465 | 11 | 1 | 5 | 5.9 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccc(C(F)(F)F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10052612 | 162888 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 526 | 12 | 1 | 4 | 6.1 | CC(C)N(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
CHEMBL419790 | 162888 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 526 | 12 | 1 | 4 | 6.1 | CC(C)N(CCc1ccc(/C(=C\CCCC(=O)O)c2cccnc2)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00027a004 | ||
10096697 | 116375 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 12 | 2 | 5 | 4.3 | COc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
CHEMBL338241 | 116375 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 12 | 2 | 5 | 4.3 | COc1ccc(S(=O)(=O)NCCc2ccc(/C(=C\CCCC(=O)O)c3cccnc3)cc2)cc1 | 10.1021/jm00027a004 | ||
10364364 | 16115 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 412 | 11 | 2 | 6 | 4.3 | O=C(CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1)NO | 10.1021/jm00047a016 | ||
CHEMBL122472 | 16115 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 412 | 11 | 2 | 6 | 4.3 | O=C(CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1)NO | 10.1021/jm00047a016 | ||
5362391 | 98639 | 21 | None | -1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00027a004 | ||
CHEMBL280728 | 98639 | 21 | None | -1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 366 | 8 | 1 | 4 | 4.1 | O=C(O)CCCCO/N=C(/c1cccnc1)c1cccc(C(F)(F)F)c1 | 10.1021/jm00027a004 | ||
9931330 | 15386 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 409 | 11 | 1 | 5 | 4.5 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL122008 | 15386 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 409 | 11 | 1 | 5 | 4.5 | O=C(O)CCCCO/N=C(/c1ccccc1)C(Cc1ccc(F)cc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10244704 | 168518 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 307 | 9 | 1 | 5 | 3.1 | O=C(O)CCCCO/N=C(\Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
CHEMBL439790 | 168518 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 307 | 9 | 1 | 5 | 3.1 | O=C(O)CCCCO/N=C(\Cn1ccnc1)C1CCCCC1 | 10.1021/jm00047a016 | ||
10254161 | 117544 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL340396 | 117544 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 10 | 2 | 4 | 4.9 | O=C(O)CCC/C=C(\c1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10371334 | 116412 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 597 | 14 | 1 | 6 | 5.0 | O=C(O)CCC/C=C(\c1ccc(CCN(CCN2CCOCC2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL338419 | 116412 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 597 | 14 | 1 | 6 | 5.0 | O=C(O)CCC/C=C(\c1ccc(CCN(CCN2CCOCC2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
131717 | 201698 | 4 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL65414 | 201698 | 4 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 14 | 2 | 4 | 4.7 | O=C(O)CCC(CCCCNS(=O)(=O)c1ccc(Cl)cc1)CCCc1cccnc1 | 10.1021/jm00027a004 | ||
10434230 | 18643 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
CHEMBL128022 | 18643 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 456 | 9 | 2 | 4 | 5.2 | O=C(O)CCC/C=C(/c1cccnc1)c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm00027a004 | ||
10256828 | 18514 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 542 | 13 | 2 | 5 | 4.7 | O=C(O)CCC/C=C(\c1ccc(CCN(CC(=O)O)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127738 | 18514 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 542 | 13 | 2 | 5 | 4.7 | O=C(O)CCC/C=C(\c1ccc(CCN(CC(=O)O)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10483231 | 19026 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 574 | 13 | 1 | 4 | 6.9 | O=C(O)CCC/C=C(\c1ccc(CCN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL129000 | 19026 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 574 | 13 | 1 | 4 | 6.9 | O=C(O)CCC/C=C(\c1ccc(CCN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
56924869 | 68039 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 487 | 8 | 1 | 4 | 5.8 | COC(=O)N(Cc1ccccc1)Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC | 10.1016/j.bmcl.2011.01.024 | ||
CHEMBL1916697 | 68039 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 487 | 8 | 1 | 4 | 5.8 | COC(=O)N(Cc1ccccc1)Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC | 10.1016/j.bmcl.2011.01.024 | ||
45270144 | 193681 | 28 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 501 | 8 | 2 | 6 | 4.1 | CN(C)c1nc(Cc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2)nc(N(C)C)c1CC(=O)O | 10.1016/j.bmcl.2009.06.085 | ||
CHEMBL551813 | 193681 | 28 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 501 | 8 | 2 | 6 | 4.1 | CN(C)c1nc(Cc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2)nc(N(C)C)c1CC(=O)O | 10.1016/j.bmcl.2009.06.085 | ||
44205724 | 68027 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 499 | 7 | 1 | 4 | 6.1 | COc1ccc(CC(=O)O)cc1-c1ccc(C(F)(F)F)cc1CN1C(=O)O[C@H](c2ccccc2)[C@@H]1C | 10.1016/j.bmcl.2011.01.024 | ||
CHEMBL1916686 | 68027 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 499 | 7 | 1 | 4 | 6.1 | COc1ccc(CC(=O)O)cc1-c1ccc(C(F)(F)F)cc1CN1C(=O)O[C@H](c2ccccc2)[C@@H]1C | 10.1016/j.bmcl.2011.01.024 | ||
10050297 | 117938 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(F)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL341094 | 117938 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 468 | 11 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(F)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10502610 | 163166 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 427 | 9 | 2 | 3 | 4.7 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2ccccc2c1 | 10.1021/jm970343g | ||
CHEMBL420507 | 163166 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 427 | 9 | 2 | 3 | 4.7 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2ccccc2c1 | 10.1021/jm970343g | ||
44159411 | 68046 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 425 | 7 | 1 | 4 | 4.6 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OC | 10.1016/j.bmcl.2011.01.024 | ||
CHEMBL1916704 | 68046 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 425 | 7 | 1 | 4 | 4.6 | CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OC | 10.1016/j.bmcl.2011.01.024 | ||
15486805 | 165500 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | ||
CHEMBL425681 | 165500 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | ||
19097508 | 98317 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL278159 | 98317 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
2449 | 202529 | 90 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 8 | 1 | 3 | 4.6 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccccc2)=C(C)C1=O | 10.1021/jm00129a030 | ||
CHEMBL70972 | 202529 | 90 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 8 | 1 | 3 | 4.6 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccccc2)=C(C)C1=O | 10.1021/jm00129a030 | ||
9801735 | 14366 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 11 | 1 | 5 | 5.2 | Cc1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
CHEMBL120250 | 14366 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 411 | 11 | 1 | 5 | 5.2 | Cc1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
10071192 | 112574 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 427 | 12 | 1 | 6 | 4.9 | COc1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
CHEMBL331218 | 112574 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 427 | 12 | 1 | 6 | 4.9 | COc1ccc(CC(/C(=N/OCCCCC(=O)O)C2CCCCC2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
46202376 | 63423 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 394 | 4 | 0 | 4 | 5.1 | COc1ccc2c(c1)C(CC1CCOCC1)(c1ccc(Cl)cc1)n1ccnc1-2 | 10.1016/j.bmcl.2010.04.016 | ||
CHEMBL1801358 | 63423 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 394 | 4 | 0 | 4 | 5.1 | COc1ccc2c(c1)C(CC1CCOCC1)(c1ccc(Cl)cc1)n1ccnc1-2 | 10.1016/j.bmcl.2010.04.016 | ||
9973005 | 114242 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 315 | 9 | 1 | 5 | 3.1 | CC(/C(=N/OCCCCC(=O)O)c1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL333868 | 114242 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 315 | 9 | 1 | 5 | 3.1 | CC(/C(=N/OCCCCC(=O)O)c1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10096378 | 17836 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 472 | 11 | 2 | 4 | 4.6 | O=C(O)CCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL126373 | 17836 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 472 | 11 | 2 | 4 | 4.6 | O=C(O)CCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10529683 | 163092 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 509 | 11 | 2 | 5 | 6.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(/N=N/c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL420404 | 163092 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 509 | 11 | 2 | 5 | 6.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(/N=N/c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm970343g | ||
10380987 | 14386 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 315 | 10 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
CHEMBL120370 | 14386 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 315 | 10 | 1 | 5 | 2.9 | O=C(O)CCCCCO/N=C(\Cn1ccnc1)c1ccccc1 | 10.1021/jm00047a016 | ||
10320883 | 13836 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 437 | 12 | 1 | 6 | 5.1 | CSc1ccc(/C(=N\OCCCCC(=O)O)C(Cc2ccccc2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
CHEMBL119661 | 13836 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 437 | 12 | 1 | 6 | 5.1 | CSc1ccc(/C(=N\OCCCCC(=O)O)C(Cc2ccccc2)n2ccnc2)cc1 | 10.1021/jm00047a016 | ||
53358921 | 64110 | 0 | None | - | 6 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813287 | 64110 | 0 | None | - | 6 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
6366700 | 14351 | 6 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 397 | 11 | 1 | 5 | 4.9 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120181 | 14351 | 6 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 397 | 11 | 1 | 5 | 4.9 | O=C(O)CCCCO/N=C(\C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10411480 | 17906 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL126761 | 17906 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 450 | 11 | 2 | 4 | 4.3 | O=C(O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccccc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10595288 | 203607 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 369 | 8 | 2 | 2 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccccc3)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL79413 | 203607 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 369 | 8 | 2 | 2 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccccc3)[C@@H]1C2 | 10.1021/jm970343g | ||
3077003 | 116585 | 2 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 486 | 12 | 2 | 4 | 5.0 | O=C(O)CCCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL339269 | 116585 | 2 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 486 | 12 | 2 | 4 | 5.0 | O=C(O)CCCCC(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
10495597 | 58971 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 316 | 3 | 4 | 6 | 2.1 | O=[N+]([O-])c1cc(CC2NCCc3cc(O)c(O)cc32)ccc1O | 10.1021/jm950896w | ||
CHEMBL170451 | 58971 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 316 | 3 | 4 | 6 | 2.1 | O=[N+]([O-])c1cc(CC2NCCc3cc(O)c(O)cc32)ccc1O | 10.1021/jm950896w | ||
10453182 | 14899 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 11 | 1 | 6 | 3.2 | O=C(O)COCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL120943 | 14899 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 11 | 1 | 6 | 3.2 | O=C(O)COCCO/N=C(\c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
10683471 | 59583 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 270 | 2 | 4 | 4 | 2.1 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
CHEMBL173039 | 59583 | 0 | None | - | 1 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 270 | 2 | 4 | 4 | 2.1 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
22901615 | 116413 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 480 | 9 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1ccc2c(c1)CC(NS(=O)(=O)c1ccc(F)cc1)C2 | 10.1021/jm00027a004 | ||
CHEMBL338420 | 116413 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 480 | 9 | 2 | 4 | 4.4 | O=C(O)CCC/C=C(/c1cccnc1)c1ccc2c(c1)CC(NS(=O)(=O)c1ccc(F)cc1)C2 | 10.1021/jm00027a004 | ||
10254733 | 18282 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 483 | 11 | 2 | 4 | 4.3 | NC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
CHEMBL127212 | 18282 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 483 | 11 | 2 | 4 | 4.3 | NC(=O)CCC/C=C(\c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1 | 10.1021/jm00027a004 | ||
9867949 | 10419 | 15 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 441 | 8 | 3 | 4 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(O)cc34)[C@@H]1C2 | 10.1021/jm970343g | ||
CHEMBL116837 | 10419 | 15 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 441 | 8 | 3 | 4 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(O)cc34)[C@@H]1C2 | 10.1021/jm970343g | ||
10431401 | 11599 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 405 | 12 | 1 | 5 | 4.7 | O=C(O)CCCCCO/N=C(/c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL118124 | 11599 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 405 | 12 | 1 | 5 | 4.7 | O=C(O)CCCCCO/N=C(/c1ccccc1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
5747298 | 169867 | 1 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 397 | 11 | 1 | 5 | 4.9 | O=C(O)CCCCO/N=C(/C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
CHEMBL444856 | 169867 | 1 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 397 | 11 | 1 | 5 | 4.9 | O=C(O)CCCCO/N=C(/C1CCCCC1)C(Cc1ccccc1)n1ccnc1 | 10.1021/jm00047a016 | ||
19884707 | 104724 | 0 | None | - | 1 | Human | 10.3 | pKd | = | 10.3 | Binding | ChEMBL | 507 | 13 | 1 | 5 | 6.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)CCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31146 | 104724 | 0 | None | - | 1 | Human | 10.3 | pKd | = | 10.3 | Binding | ChEMBL | 507 | 13 | 1 | 5 | 6.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)CCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
14952347 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(01)81106-9 | ||
CHEMBL31765 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(01)81106-9 | ||
14952347 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80592-2 | ||
CHEMBL31765 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80592-2 | ||
14952347 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31765 | 106867 | 0 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
14952443 | 102448 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 536 | 12 | 2 | 5 | 5.6 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(Cl)cc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL30615 | 102448 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 536 | 12 | 2 | 5 | 5.6 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(Cl)cc2)co1 | 10.1021/jm00062a013 | ||
14952423 | 102603 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 468 | 13 | 2 | 5 | 4.9 | CCCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL30743 | 102603 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 468 | 13 | 2 | 5 | 4.9 | CCCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
19875349 | 98829 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 532 | 13 | 2 | 6 | 5.0 | COc1ccc(CCCCNC(=O)c2coc(C3C4CCC(O4)C3Cc3ccccc3CCC(=O)O)n2)cc1 | 10.1021/jm00062a013 | ||
CHEMBL281959 | 98829 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 532 | 13 | 2 | 6 | 5.0 | COc1ccc(CCCCNC(=O)c2coc(C3C4CCC(O4)C3Cc3ccccc3CCC(=O)O)n2)cc1 | 10.1021/jm00062a013 | ||
19875370 | 99133 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 502 | 12 | 2 | 5 | 4.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccccc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL283923 | 99133 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 502 | 12 | 2 | 5 | 4.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccccc2)co1 | 10.1021/jm00062a013 | ||
52935553 | 77615 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CC/C=C\CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL2096756 | 77615 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 352 | 12 | 1 | 3 | 5.1 | CC/C=C\CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
44458593 | 94887 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 466 | 9 | 2 | 4 | 5.4 | O=C(O)CCc1ccccc1C[C@@H]1CCC[C@H]1c1nc(C(=O)NCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL25657 | 94887 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 466 | 9 | 2 | 4 | 5.4 | O=C(O)CCc1ccccc1C[C@@H]1CCC[C@H]1c1nc(C(=O)NCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
19875466 | 100517 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 518 | 12 | 3 | 6 | 4.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(O)cc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL29429 | 100517 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 518 | 12 | 3 | 6 | 4.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(O)cc2)co1 | 10.1021/jm00062a013 | ||
19875479 | 103702 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 482 | 11 | 2 | 5 | 5.1 | CC(C)(C)CCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL30972 | 103702 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 482 | 11 | 2 | 5 | 5.1 | CC(C)(C)CCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
19875360 | 107337 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 480 | 10 | 2 | 5 | 4.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31922 | 107337 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 480 | 10 | 2 | 5 | 4.9 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
19875435 | 159400 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 474 | 10 | 2 | 5 | 4.2 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccccc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL410732 | 159400 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 474 | 10 | 2 | 5 | 4.2 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccccc2)co1 | 10.1021/jm00062a013 | ||
19875423 | 98787 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 440 | 9 | 2 | 5 | 4.1 | CCC(C)(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL281726 | 98787 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 440 | 9 | 2 | 5 | 4.1 | CCC(C)(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
44279917 | 104813 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 522 | 13 | 2 | 5 | 6.1 | O=C(O)CCCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31154 | 104813 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 522 | 13 | 2 | 5 | 6.1 | O=C(O)CCCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
44279871 | 99578 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 509 | 12 | 1 | 6 | 6.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)OCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL286978 | 99578 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 509 | 12 | 1 | 6 | 6.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)OCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
20844482 | 206021 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 421 | 8 | 3 | 4 | 3.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
CHEMBL95872 | 206021 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Binding | ChEMBL | 421 | 8 | 3 | 4 | 3.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
13799378 | 103978 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 462 | 14 | 3 | 4 | 4.0 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CCCC1CCCCC1 | 10.1021/jm00171a021 | ||
CHEMBL310406 | 103978 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | 462 | 14 | 3 | 4 | 4.0 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CCCC1CCCCC1 | 10.1021/jm00171a021 | ||
18675848 | 99373 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.3 | O=C(O)Cc1cccc(CC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
CHEMBL285596 | 99373 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.3 | O=C(O)Cc1cccc(CC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
19097508 | 98317 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL278159 | 98317 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
19097508 | 98317 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL278159 | 98317 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 508 | 10 | 2 | 5 | 4.8 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1021/jm00062a013 | ||
118718127 | 114777 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CC[C@@H](O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL3349042 | 114777 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 354 | 13 | 1 | 3 | 5.3 | CCCCCCSC[C@H]1C2CC[C@@H](O2)[C@H]1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
19875425 | 101938 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 585 | 13 | 2 | 7 | 4.7 | CS(=O)(=O)NC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL30398 | 101938 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 585 | 13 | 2 | 7 | 4.7 | CS(=O)(=O)NC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
19973038 | 167641 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 412 | 9 | 2 | 5 | 3.3 | CCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL433435 | 167641 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 412 | 9 | 2 | 5 | 3.3 | CCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
19097519 | 161723 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 524 | 12 | 2 | 5 | 6.6 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(/C(S)=N/CCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL416395 | 161723 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 524 | 12 | 2 | 5 | 6.6 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(/C(S)=N/CCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
3356 | 2248 | 68 | None | -38 | 8 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
4326 | 2248 | 68 | None | -38 | 8 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
9867642 | 2248 | 68 | None | -38 | 8 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
CHEMBL426559 | 2248 | 68 | None | -38 | 8 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
DB11629 | 2248 | 68 | None | -38 | 8 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
54757965 | 64949 | 0 | None | - | 1 | Mouse | 5.0 | pKd | = | 5 | Binding | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1828642 | 64949 | 0 | None | - | 1 | Mouse | 5.0 | pKd | = | 5 | Binding | ChEMBL | 353 | 8 | 2 | 3 | 2.8 | O=S(=O)(NCCc1cccc(CCCO)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
19838931 | 206598 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 421 | 8 | 3 | 4 | 3.8 | O=C(O)Cc1cccc(CCC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
CHEMBL99348 | 206598 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 421 | 8 | 3 | 4 | 3.8 | O=C(O)Cc1cccc(CCC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
19104215 | 87532 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 481 | 12 | 2 | 5 | 5.5 | O=C(O)CCc1ccccc1CN1CCCC1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80328-5 | ||
CHEMBL23414 | 87532 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 481 | 12 | 2 | 5 | 5.5 | O=C(O)CCc1ccccc1CN1CCCC1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80328-5 | ||
54669847 | 65122 | 0 | None | 18 | 2 | Mouse | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829805 | 65122 | 0 | None | 18 | 2 | Mouse | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
19875443 | 162709 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 454 | 11 | 1 | 5 | 4.5 | CCCCCN(C)C(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL418583 | 162709 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 454 | 11 | 1 | 5 | 4.5 | CCCCCN(C)C(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
23302977 | 200952 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 543 | 15 | 2 | 5 | 7.7 | O=C(O)CCCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL61306 | 200952 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 543 | 15 | 2 | 5 | 7.7 | O=C(O)CCCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44301139 | 101577 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1cccnc1)c1ccccc1C1=N[C@@H](C(=O)NCCCCC2CCCCC2)CO1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL301904 | 101577 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1cccnc1)c1ccccc1C1=N[C@@H](C(=O)NCCCCC2CCCCC2)CO1 | 10.1016/s0960-894x(98)00353-9 | ||
19813455 | 98921 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 494 | 12 | 2 | 5 | 5.6 | O=C(NCCCCC1CCCCC1)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCCO)n1 | 10.1021/jm00062a013 | ||
CHEMBL282601 | 98921 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 494 | 12 | 2 | 5 | 5.6 | O=C(NCCCCC1CCCCC1)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCCO)n1 | 10.1021/jm00062a013 | ||
15462459 | 101201 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 447 | 11 | 2 | 5 | 3.8 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCC3CC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL299280 | 101201 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 447 | 11 | 2 | 5 | 3.8 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCC3CC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
54757867 | 65120 | 0 | None | -9 | 2 | Human | 4.9 | pKd | = | 4.9 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(O)=C1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL1829803 | 65120 | 0 | None | -9 | 2 | Human | 4.9 | pKd | = | 4.9 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(O)=C1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
54757867 | 65120 | 0 | None | 9 | 2 | Mouse | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(O)=C1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL1829803 | 65120 | 0 | None | 9 | 2 | Mouse | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.6 | O=C1CCC(O)=C1Cc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
14673099 | 107032 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 423 | 8 | 3 | 5 | 3.3 | O=C(O)COc1cccc(CC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
CHEMBL318673 | 107032 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 423 | 8 | 3 | 5 | 3.3 | O=C(O)COc1cccc(CC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
10369704 | 100426 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL293764 | 100426 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1cccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
14885216 | 203594 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 438 | 15 | 3 | 4 | 4.4 | CCCCCC/C(S)=N/CC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
CHEMBL79287 | 203594 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 438 | 15 | 3 | 4 | 4.4 | CCCCCC/C(S)=N/CC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
15462462 | 196585 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 481 | 11 | 2 | 5 | 5.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCc3ccccc3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL57576 | 196585 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 481 | 11 | 2 | 5 | 5.7 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCc3ccccc3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
71452805 | 79286 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 282 | 2 | 0 | 2 | 4.4 | CC1(C)C2CC[C@H](Cc3cccc4ccc(=O)oc34)C1C2 | 10.1016/0960-894X(95)00284-Z | ||
CHEMBL2115413 | 79286 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 282 | 2 | 0 | 2 | 4.4 | CC1(C)C2CC[C@H](Cc3cccc4ccc(=O)oc34)C1C2 | 10.1016/0960-894X(95)00284-Z | ||
10546960 | 201664 | 0 | None | -70 | 3 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL65121 | 201664 | 0 | None | -70 | 3 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
15852312 | 199818 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL60516 | 199818 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44301318 | 195451 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL56778 | 195451 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
15852311 | 197118 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL58332 | 197118 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
15458912 | 100128 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1cccnc1)c1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL291789 | 100128 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1cccnc1)c1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/s0960-894x(98)00353-9 | ||
44301194 | 100097 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 461 | 13 | 2 | 5 | 5.7 | CCCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL291539 | 100097 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 461 | 13 | 2 | 5 | 5.7 | CCCCCNC(=O)c1coc(-c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)n1 | 10.1016/s0960-894x(98)00353-9 | ||
19875405 | 98644 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)Cc1cccc(CCC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
CHEMBL280786 | 98644 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 508 | 12 | 2 | 5 | 5.7 | O=C(O)Cc1cccc(CCC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
54758054 | 65119 | 0 | None | 20 | 2 | Mouse | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
CHEMBL1829802 | 65119 | 0 | None | 20 | 2 | Mouse | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
13799369 | 203856 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 436 | 16 | 3 | 4 | 3.6 | CCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
CHEMBL81263 | 203856 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 436 | 16 | 3 | 4 | 3.6 | CCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
44209494 | 206557 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 407 | 7 | 3 | 4 | 3.5 | O=C(O)Cc1cccc(CC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
CHEMBL99041 | 206557 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 407 | 7 | 3 | 4 | 3.5 | O=C(O)Cc1cccc(CC2C3CCC(O3)C2/C=N/NC(=O)Nc2ccccc2)c1 | 10.1021/jm00113a030 | ||
15052910 | 191329 | 1 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 313 | 11 | 2 | 3 | 2.8 | O=C(O)CCCCCCCCNS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
CHEMBL52003 | 191329 | 1 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 313 | 11 | 2 | 3 | 2.8 | O=C(O)CCCCCCCCNS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
19875358 | 99535 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.7 | O=C(O)c1cccc(CCC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
CHEMBL286708 | 99535 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.7 | O=C(O)c1cccc(CCC2C3CCC(O3)C2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1021/jm00062a013 | ||
44301250 | 200605 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(/c1cccnc1)c1ccccc1C1=N[C@@H](C(=O)NCCCCC2CCCCC2)CO1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL61021 | 200605 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(/c1cccnc1)c1ccccc1C1=N[C@@H](C(=O)NCCCCC2CCCCC2)CO1 | 10.1016/s0960-894x(98)00353-9 | ||
54758053 | 65118 | 0 | None | 17 | 2 | Mouse | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1829801 | 65118 | 0 | None | 17 | 2 | Mouse | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
18944178 | 59042 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 488 | 12 | 2 | 4 | 6.4 | O=C(O)CCc1ccccc1Cc1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80592-2 | ||
CHEMBL170747 | 59042 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 488 | 12 | 2 | 4 | 6.4 | O=C(O)CCc1ccccc1Cc1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80592-2 | ||
19875392 | 99633 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL287421 | 99633 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 426 | 7 | 2 | 5 | 3.7 | CC(C)(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
19813457 | 104061 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.3 | O=C(O)Cc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31043 | 104061 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 5.3 | O=C(O)Cc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
44461598 | 105373 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 476 | 15 | 3 | 4 | 4.4 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CCCCC1CCCCC1 | 10.1021/jm00171a021 | ||
CHEMBL312732 | 105373 | 0 | None | - | 1 | Human | 8.6 | pKd | = | 8.6 | Binding | ChEMBL | 476 | 15 | 3 | 4 | 4.4 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CCCCC1CCCCC1 | 10.1021/jm00171a021 | ||
19875446 | 99590 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 548 | 13 | 2 | 6 | 5.7 | CSc1ccc(CCCCNC(=O)c2coc(C3C4CCC(O4)C3Cc3ccccc3CCC(=O)O)n2)cc1 | 10.1021/jm00062a013 | ||
CHEMBL287068 | 99590 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 548 | 13 | 2 | 6 | 5.7 | CSc1ccc(CCCCNC(=O)c2coc(C3C4CCC(O4)C3Cc3ccccc3CCC(=O)O)n2)cc1 | 10.1021/jm00062a013 | ||
44279758 | 107000 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 454 | 9 | 2 | 5 | 4.4 | CC(C)(C)CCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL31850 | 107000 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 454 | 9 | 2 | 5 | 4.4 | CC(C)(C)CCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
6913677 | 184749 | 1 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 377 | 9 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\CC1C2CCC(C2)C1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
CHEMBL48597 | 184749 | 1 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 377 | 9 | 2 | 3 | 3.6 | O=C(O)CCC/C=C\CC1C2CCC(C2)C1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
44279913 | 102580 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 456 | 12 | 3 | 6 | 3.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCCO)co1 | 10.1021/jm00062a013 | ||
CHEMBL30727 | 102580 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 456 | 12 | 3 | 6 | 3.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCCO)co1 | 10.1021/jm00062a013 | ||
54669847 | 65122 | 0 | None | -18 | 2 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
CHEMBL1829805 | 65122 | 0 | None | -18 | 2 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 405 | 7 | 2 | 4 | 3.4 | O=C1C=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)C1 | 10.1021/jm200980u | ||
44329879 | 206019 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 435 | 9 | 3 | 4 | 4.2 | O=C(O)CCCc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
CHEMBL95867 | 206019 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 435 | 9 | 3 | 4 | 4.2 | O=C(O)CCCc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
19875478 | 101883 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 551 | 13 | 3 | 6 | 4.5 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC(=O)NC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL30377 | 101883 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 551 | 13 | 3 | 6 | 4.5 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC(=O)NC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
19875474 | 109158 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 509 | 12 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCN2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL2368531 | 109158 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 509 | 12 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCN2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL32237 | 109158 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 509 | 12 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCN2CCCCC2)co1 | 10.1021/jm00062a013 | ||
18666327 | 84237 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 480 | 12 | 2 | 4 | 6.3 | O=C(O)CCc1ccccc1C[C@@H]1CCC[C@@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL22244 | 84237 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 480 | 12 | 2 | 4 | 6.3 | O=C(O)CCc1ccccc1C[C@@H]1CCC[C@@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
44301207 | 101295 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 463 | 13 | 2 | 5 | 4.6 | CCCCCNC(=O)[C@@H]1COC(c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)=N1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL299886 | 101295 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 463 | 13 | 2 | 5 | 4.6 | CCCCCNC(=O)[C@@H]1COC(c2ccc(/C(=C\CCCCC(=O)O)c3cccnc3)cc2)=N1 | 10.1016/s0960-894x(98)00353-9 | ||
54669848 | 65123 | 0 | None | 12 | 2 | Mouse | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
CHEMBL1829806 | 65123 | 0 | None | 12 | 2 | Mouse | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
10546960 | 201664 | 0 | None | -13 | 3 | Mouse | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
CHEMBL65121 | 201664 | 0 | None | -13 | 3 | Mouse | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 367 | 8 | 2 | 3 | 2.9 | O=C(O)CCc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/jm200980u | ||
19875366 | 101234 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 412 | 8 | 2 | 5 | 3.3 | CC(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL29947 | 101234 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 412 | 8 | 2 | 5 | 3.3 | CC(C)NC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
44461401 | 105146 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 454 | 15 | 3 | 4 | 5.6 | CCCCCC/C(S)=N/C/C(S)=N/CC1C2CC[C@@H](O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
CHEMBL312360 | 105146 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 454 | 15 | 3 | 4 | 5.6 | CCCCCC/C(S)=N/C/C(S)=N/CC1C2CC[C@@H](O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
18675853 | 102720 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 510 | 12 | 2 | 6 | 5.1 | O=C(O)COc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL30832 | 102720 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 510 | 12 | 2 | 6 | 5.1 | O=C(O)COc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
44458568 | 89018 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 466 | 9 | 2 | 4 | 5.4 | O=C(O)CCc1ccccc1C[C@H]1CCC[C@@H]1c1nc(C(=O)NCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL23711 | 89018 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 466 | 9 | 2 | 4 | 5.4 | O=C(O)CCc1ccccc1C[C@H]1CCC[C@@H]1c1nc(C(=O)NCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
19875414 | 102336 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 520 | 12 | 2 | 5 | 5.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(F)cc2)co1 | 10.1021/jm00062a013 | ||
CHEMBL30537 | 102336 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 520 | 12 | 2 | 5 | 5.1 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCc2ccc(F)cc2)co1 | 10.1021/jm00062a013 | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
54669848 | 65123 | 0 | None | -12 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
CHEMBL1829806 | 65123 | 0 | None | -12 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 419 | 7 | 2 | 4 | 3.8 | CC1=C(O)C(Cc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)CC1=O | 10.1021/jm200980u | ||
15462454 | 195365 | 0 | None | - | 1 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 515 | 13 | 2 | 5 | 6.9 | O=C(O)CCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL56722 | 195365 | 0 | None | - | 1 | Human | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 515 | 13 | 2 | 5 | 6.9 | O=C(O)CCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
54758053 | 65118 | 0 | None | -17 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
CHEMBL1829801 | 65118 | 0 | None | -17 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 391 | 8 | 2 | 5 | 2.2 | O=S(=O)(NCCc1cccc(CCc2nn[nH]n2)c1)c1ccc(Cl)cc1 | 10.1021/jm200980u | ||
54758054 | 65119 | 0 | None | -20 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
CHEMBL1829802 | 65119 | 0 | None | -20 | 2 | Human | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 420 | 8 | 3 | 6 | 1.8 | O=c1c(O)c(NCc2cccc(CCNS(=O)(=O)c3ccc(Cl)cc3)c2)c1=O | 10.1021/jm200980u | ||
44280058 | 98866 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 536 | 12 | 2 | 5 | 6.3 | CC(C)(Cc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1)C(=O)O | 10.1021/jm00062a013 | ||
CHEMBL282186 | 98866 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 536 | 12 | 2 | 5 | 6.3 | CC(C)(Cc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC2CCCCC2)co1)C(=O)O | 10.1021/jm00062a013 | ||
44295187 | 188154 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 351 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@H]1CCC[C@H]1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
CHEMBL50507 | 188154 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 351 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@H]1CCC[C@H]1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
44458583 | 165164 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 466 | 10 | 2 | 4 | 5.4 | C/C(Cc1ccccc1CCC(=O)O)=C(\C)c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL424587 | 165164 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 466 | 10 | 2 | 4 | 5.4 | C/C(Cc1ccccc1CCC(=O)O)=C(\C)c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
15462461 | 199939 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 483 | 11 | 2 | 5 | 4.6 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCc3ccccc3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL60587 | 199939 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 483 | 11 | 2 | 5 | 4.6 | O=C(O)CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCc3ccccc3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44329690 | 106992 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 385 | 9 | 3 | 4 | 3.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
CHEMBL318426 | 106992 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 385 | 9 | 3 | 4 | 3.8 | O=C(O)CCC/C=C\CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
21865528 | 99004 | 5 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL283100 | 99004 | 5 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1016/S0960-894X(00)80330-3 | ||
21865528 | 99004 | 5 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL283100 | 99004 | 5 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
1987 | 1958 | 16 | None | 1 | 2 | Rat | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 10.1016/S0960-894X(00)80658-7 | ||
3037233 | 1958 | 16 | None | 1 | 2 | Rat | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 10.1016/S0960-894X(00)80658-7 | ||
CHEMBL3301673 | 1958 | 16 | None | 1 | 2 | Rat | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 10.1016/S0960-894X(00)80658-7 | ||
DB12321 | 1958 | 16 | None | 1 | 2 | Rat | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 10.1016/S0960-894X(00)80658-7 | ||
44461226 | 204113 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 516 | 13 | 3 | 5 | 4.3 | CC(C)(C)c1ccc(SCC(=O)NCC(=O)NCC2C3CCC(O3)C2C/C=C/CCCC(=O)O)cc1 | 10.1021/jm00171a021 | ||
CHEMBL83366 | 204113 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 516 | 13 | 3 | 5 | 4.3 | CC(C)(C)c1ccc(SCC(=O)NCC(=O)NCC2C3CCC(O3)C2C/C=C/CCCC(=O)O)cc1 | 10.1021/jm00171a021 | ||
44458582 | 164940 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 480 | 12 | 2 | 4 | 6.3 | O=C(O)CCc1ccccc1CC1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL424031 | 164940 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 480 | 12 | 2 | 4 | 6.3 | O=C(O)CCc1ccccc1CC1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80329-7 | ||
14952432 | 105585 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 452 | 8 | 2 | 5 | 4.3 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
CHEMBL31334 | 105585 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 452 | 8 | 2 | 5 | 4.3 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NC2CCCCC2)co1 | 10.1021/jm00062a013 | ||
44279724 | 162070 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 464 | 12 | 2 | 5 | 4.1 | C#CCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL416943 | 162070 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 464 | 12 | 2 | 5 | 4.1 | C#CCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
44279891 | 98716 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 4.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC(F)(F)F)co1 | 10.1021/jm00062a013 | ||
CHEMBL281293 | 98716 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 494 | 11 | 2 | 5 | 4.7 | O=C(O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(C(=O)NCCCCC(F)(F)F)co1 | 10.1021/jm00062a013 | ||
13799389 | 203593 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 460 | 13 | 3 | 5 | 3.0 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CSc1ccccc1 | 10.1021/jm00171a021 | ||
CHEMBL79278 | 203593 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 460 | 13 | 3 | 5 | 3.0 | O=C(O)CCC/C=C/CC1C2CCC(O2)C1CNC(=O)CNC(=O)CSc1ccccc1 | 10.1021/jm00171a021 | ||
71450971 | 79207 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 282 | 2 | 0 | 2 | 4.4 | CC1(C)C2CC[C@@H](Cc3cccc4ccc(=O)oc34)C1C2 | 10.1016/0960-894X(95)00284-Z | ||
CHEMBL2114959 | 79207 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 282 | 2 | 0 | 2 | 4.4 | CC1(C)C2CC[C@@H](Cc3cccc4ccc(=O)oc34)C1C2 | 10.1016/0960-894X(95)00284-Z | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
14952419 | 116029 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 384 | 7 | 2 | 5 | 2.6 | CNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL33621 | 116029 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 384 | 7 | 2 | 5 | 2.6 | CNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
44387219 | 60202 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 324 | 11 | 1 | 3 | 4.3 | C=CCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL175751 | 60202 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 324 | 11 | 1 | 3 | 4.3 | C=CCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
13799369 | 203856 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 436 | 16 | 3 | 4 | 3.6 | CCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
CHEMBL81263 | 203856 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 436 | 16 | 3 | 4 | 3.6 | CCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
14952425 | 162710 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 510 | 16 | 2 | 5 | 6.1 | CCCCCCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
CHEMBL418585 | 162710 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 510 | 16 | 2 | 5 | 6.1 | CCCCCCCCCCNC(=O)c1coc(C2C3CCC(O3)C2Cc2ccccc2CCC(=O)O)n1 | 10.1021/jm00062a013 | ||
44301170 | 198346 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(/c1ccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL59547 | 198346 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(/c1ccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
15458911 | 100463 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL293971 | 100463 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(/c1cccnc1)c1ccccc1-c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/s0960-894x(98)00353-9 | ||
19838907 | 206024 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 423 | 8 | 3 | 5 | 3.3 | O=C(O)COc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
CHEMBL95884 | 206024 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 423 | 8 | 3 | 5 | 3.3 | O=C(O)COc1ccccc1CC1C2CCC(O2)C1/C=N/NC(=O)Nc1ccccc1 | 10.1021/jm00113a030 | ||
18944163 | 84627 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 492 | 10 | 2 | 4 | 5.9 | O=C(O)CCc1ccccc1CC1=C(c2nc(C(=O)NCCc3ccc(Cl)cc3)co2)CCCC1 | 10.1016/S0960-894X(00)80329-7 | ||
CHEMBL22418 | 84627 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 492 | 10 | 2 | 4 | 5.9 | O=C(O)CCc1ccccc1CC1=C(c2nc(C(=O)NCCc3ccc(Cl)cc3)co2)CCCC1 | 10.1016/S0960-894X(00)80329-7 | ||
15462456 | 196313 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1cccnc1)c1cccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL57359 | 196313 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1cccnc1)c1cccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
44295061 | 188334 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 311 | 10 | 2 | 3 | 2.6 | O=C(O)CCC/C=C/CCCNS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
CHEMBL50785 | 188334 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 311 | 10 | 2 | 3 | 2.6 | O=C(O)CCC/C=C/CCCNS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
44295209 | 101398 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 351 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@H]1CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
CHEMBL300681 | 101398 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 351 | 9 | 2 | 3 | 3.3 | O=C(O)CCC/C=C\C[C@H]1CCC[C@@H]1NS(=O)(=O)c1ccccc1 | 10.1016/S0960-894X(01)80794-0 | ||
71454591 | 79303 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 509 | 11 | 2 | 6 | 4.7 | O=C(O)CCc1ccccc1C(=O)N1C(=O)CCC1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80328-5 | ||
CHEMBL2115542 | 79303 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 509 | 11 | 2 | 6 | 4.7 | O=C(O)CCc1ccccc1C(=O)N1C(=O)CCC1c1nc(C(=O)NCCCCC2CCCCC2)co1 | 10.1016/S0960-894X(00)80328-5 | ||
44387220 | 62063 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 310 | 10 | 1 | 3 | 3.9 | C=CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL177949 | 62063 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 310 | 10 | 1 | 3 | 3.9 | C=CCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
15462460 | 200159 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 445 | 11 | 2 | 5 | 5.0 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCC3CC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL60710 | 200159 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 445 | 11 | 2 | 5 | 5.0 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCC3CC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44210947 | 98659 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 498 | 10 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1COCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL280890 | 98659 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 498 | 10 | 2 | 6 | 4.2 | O=C(O)CCc1ccccc1CC1COCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
18944131 | 86767 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
CHEMBL23273 | 86767 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.0 | O=C(O)CCc1ccccc1CC1OCOC1c1nc(C(=O)NCCc2ccc(Cl)cc2)co1 | 10.1016/S0960-894X(00)80330-3 | ||
13799367 | 203960 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 450 | 17 | 3 | 4 | 4.0 | CCCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
CHEMBL82146 | 203960 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 450 | 17 | 3 | 4 | 4.0 | CCCCCCCCC(=O)NCC(=O)NCC1C2CCC(O2)C1C/C=C/CCCC(=O)O | 10.1021/jm00171a021 | ||
5284442 | 96727 | 23 | None | -1 | 2 | Human | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL26820 | 96727 | 23 | None | -1 | 2 | Human | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 281 | 7 | 1 | 2 | 4.2 | O=C(O)CCCC/C=C(\c1ccccc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44301140 | 100611 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1cccnc1)c1cccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL294850 | 100611 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 531 | 14 | 2 | 5 | 6.2 | O=C(O)CCCC/C=C(\c1cccnc1)c1cccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)c1 | 10.1016/s0960-894x(98)00353-9 | ||
9958626 | 101233 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL299467 | 101233 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 529 | 14 | 2 | 5 | 7.3 | O=C(O)CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
15852309 | 162665 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 501 | 12 | 2 | 5 | 6.5 | O=C(O)CC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
CHEMBL418323 | 162665 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 501 | 12 | 2 | 5 | 6.5 | O=C(O)CC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1 | 10.1016/s0960-894x(98)00353-9 | ||
44385711 | 60135 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 312 | 10 | 1 | 3 | 4.1 | CCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
CHEMBL175303 | 60135 | 0 | None | - | 1 | Human | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 312 | 10 | 1 | 3 | 4.1 | CCCSCC1C2CCC(O2)C1C/C=C\CCCC(=O)O | 10.1021/jm00125a009 | ||
123879 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
1910 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
1911 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
2354 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL361812 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
DB13036 | 3235 | 77 | None | 3 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1016/j.bmcl.2010.11.015 | ||
11597294 | 165623 | 4 | None | 1 | 8 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
CHEMBL426387 | 165623 | 4 | None | 1 | 8 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | ||
10369249 | 167309 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(=O)NCc4ccccc4)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL431075 | 167309 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(=O)NCc4ccccc4)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
14372497 | 76953 | 0 | None | 6 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 389 | 4 | 1 | 2 | 5.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(F)cc(F)cc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL208260 | 76953 | 0 | None | 6 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 389 | 4 | 1 | 2 | 5.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(F)cc(F)cc21 | 10.1016/j.bmcl.2006.02.062 | ||
10365193 | 165180 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc([N+](=O)[O-])ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL424621 | 165180 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc([N+](=O)[O-])ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10094735 | 10072 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 439 | 6 | 2 | 5 | 4.9 | Cc1ccsc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
CHEMBL115924 | 10072 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 439 | 6 | 2 | 5 | 4.9 | Cc1ccsc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
9984004 | 11222 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(=O)NCc4ccccc4)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL117943 | 11222 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 515 | 6 | 2 | 5 | 5.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(=O)NCc4ccccc4)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
11495634 | 14736 | 7 | None | -1 | 4 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.4 | O=C(O)c1cccc(Cc2cc(Cl)ccc2OCc2ccc(Cl)cc2F)n1 | 10.1016/j.bmcl.2009.02.112 | ||
CHEMBL1207972 | 14736 | 7 | None | -1 | 4 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.4 | O=C(O)c1cccc(Cc2cc(Cl)ccc2OCc2ccc(Cl)cc2F)n1 | 10.1016/j.bmcl.2009.02.112 | ||
CHEMBL467114 | 14736 | 7 | None | -1 | 4 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.4 | O=C(O)c1cccc(Cc2cc(Cl)ccc2OCc2ccc(Cl)cc2F)n1 | 10.1016/j.bmcl.2009.02.112 | ||
10094735 | 10072 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 439 | 6 | 2 | 5 | 4.9 | Cc1ccsc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
CHEMBL115924 | 10072 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 439 | 6 | 2 | 5 | 4.9 | Cc1ccsc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
53323267 | 56530 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643785 | 56530 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
9868012 | 123331 | 0 | None | -50 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 420 | 6 | 1 | 3 | 7.0 | O=C(O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL362543 | 123331 | 0 | None | -50 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 420 | 6 | 1 | 3 | 7.0 | O=C(O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
44411552 | 76733 | 0 | None | -24 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 524 | 6 | 1 | 4 | 4.9 | CN(C)S(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207451 | 76733 | 0 | None | -24 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 524 | 6 | 1 | 4 | 4.9 | CN(C)S(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10548754 | 16206 | 0 | None | -154 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 396 | 2 | 4 | 4 | 2.7 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
CHEMBL122990 | 16206 | 0 | None | -154 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 396 | 2 | 4 | 4 | 2.7 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
53321924 | 56541 | 0 | None | -190 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 432 | 5 | 1 | 4 | 3.6 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643796 | 56541 | 0 | None | -190 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 432 | 5 | 1 | 4 | 3.6 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
35028115 | 141467 | 4 | None | -109 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL387477 | 141467 | 4 | None | -109 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
3078930 | 164350 | 5 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 4.5 | COc1ccccc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
CHEMBL422253 | 164350 | 5 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 4.5 | COc1ccccc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
10047807 | 9700 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 421 | 5 | 2 | 4 | 3.7 | O=C(O)c1ccc2c(c1)/C(=C/CNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL113670 | 9700 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 421 | 5 | 2 | 4 | 3.7 | O=C(O)c1ccc2c(c1)/C(=C/CNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
3078930 | 164350 | 5 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 4.5 | COc1ccccc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
CHEMBL422253 | 164350 | 5 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 4.5 | COc1ccccc1C(=O)NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a016 | ||
14953108 | 97763 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 418 | 6 | 1 | 3 | 5.0 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Br)cc1F | 10.1021/jm00061a008 | ||
CHEMBL274287 | 97763 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 418 | 6 | 1 | 3 | 5.0 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Br)cc1F | 10.1021/jm00061a008 | ||
10181442 | 95892 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(Cc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL261501 | 95892 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(Cc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44411606 | 76800 | 0 | None | -112 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 5 | 1 | 5 | 4.1 | CS(=O)(=O)c1cc(C#N)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207805 | 76800 | 0 | None | -112 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 5 | 1 | 5 | 4.1 | CS(=O)(=O)c1cc(C#N)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
9895436 | 106533 | 0 | None | -61 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
CHEMBL315391 | 106533 | 0 | None | -61 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
44338286 | 6153 | 0 | None | -85 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 6.3 | CC(C)(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108146 | 6153 | 0 | None | -85 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 422 | 6 | 1 | 4 | 6.3 | CC(C)(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
10024655 | 110107 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.8 | COc1ccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
CHEMBL325523 | 110107 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.8 | COc1ccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
14953092 | 60129 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 424 | 6 | 1 | 3 | 6.1 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm00061a008 | ||
CHEMBL17528 | 60129 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 424 | 6 | 1 | 3 | 6.1 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm00061a008 | ||
14953089 | 60736 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 418 | 6 | 1 | 3 | 5.0 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17640 | 60736 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 418 | 6 | 1 | 3 | 5.0 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
10207799 | 64744 | 0 | None | -28 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 475 | 6 | 1 | 4 | 7.3 | OC(c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)C(F)(F)F | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL182368 | 64744 | 0 | None | -28 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 475 | 6 | 1 | 4 | 7.3 | OC(c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)C(F)(F)F | 10.1016/j.bmcl.2004.12.005 | ||
44392527 | 122386 | 0 | None | -97 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 8.2 | CC(NC(=O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)c1cccnc1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL360592 | 122386 | 0 | None | -97 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 8.2 | CC(NC(=O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)c1cccnc1 | 10.1016/j.bmcl.2004.12.005 | ||
11408533 | 140796 | 0 | None | -467 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL383484 | 140796 | 0 | None | -467 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
11408533 | 140796 | 0 | None | -467 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL383484 | 140796 | 0 | None | -467 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
11189801 | 189020 | 0 | None | -5888 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 436 | 5 | 1 | 6 | 4.2 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL514802 | 189020 | 0 | None | -5888 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 436 | 5 | 1 | 6 | 4.2 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
53323268 | 56533 | 0 | None | -251 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 456 | 7 | 1 | 4 | 3.8 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(CC1CC1)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643788 | 56533 | 0 | None | -251 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 456 | 7 | 1 | 4 | 3.8 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(CC1CC1)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
14953096 | 63939 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 434 | 6 | 1 | 3 | 5.5 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
CHEMBL18093 | 63939 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 434 | 6 | 1 | 3 | 5.5 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
44591807 | 191968 | 0 | None | -6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 448 | 5 | 1 | 4 | 7.0 | CC(C)c1ccnc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL521290 | 191968 | 0 | None | -6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 448 | 5 | 1 | 4 | 7.0 | CC(C)c1ccnc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
16049493 | 77875 | 0 | None | -75 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S@+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210707 | 77875 | 0 | None | -75 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S@+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
10409291 | 163314 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4cc(C(=O)O)ccc4COc4ccccc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL420678 | 163314 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4cc(C(=O)O)ccc4COc4ccccc43)c2cc1C | 10.1021/jm00096a017 | ||
51550 | 204036 | 9 | None | -11 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00096a016 | ||
CHEMBL8273 | 204036 | 9 | None | -11 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00096a016 | ||
51550 | 204036 | 9 | None | -11 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00096a016 | ||
CHEMBL8273 | 204036 | 9 | None | -11 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00096a016 | ||
53321923 | 56526 | 0 | None | -234 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 4.4 | CN([C@@H]1CCc2c(CC(=O)O)c3c(Cl)cc(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643781 | 56526 | 0 | None | -234 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 4.4 | CN([C@@H]1CCc2c(CC(=O)O)c3c(Cl)cc(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
53322785 | 56535 | 0 | None | -363 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 4.0 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(CC(F)(F)F)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643790 | 56535 | 0 | None | -363 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 484 | 6 | 1 | 4 | 4.0 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(CC(F)(F)F)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
10136631 | 160687 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 6.4 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)cc1)c1c(C3CC3)cc(F)cc12 | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL411847 | 160687 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 6.4 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)cc1)c1c(C3CC3)cc(F)cc12 | 10.1016/j.bmcl.2008.03.015 | ||
11384493 | 3777 | 30 | None | -1071 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | OC(=O)Cn1c2CCC(Cc2c2c1cccc2)N(S(=O)(=O)c1ccc(cc1)F)C | 10.1016/j.bmcl.2010.11.015 | ||
1905 | 3777 | 30 | None | -1071 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | OC(=O)Cn1c2CCC(Cc2c2c1cccc2)N(S(=O)(=O)c1ccc(cc1)F)C | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643768 | 3777 | 30 | None | -1071 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | OC(=O)Cn1c2CCC(Cc2c2c1cccc2)N(S(=O)(=O)c1ccc(cc1)F)C | 10.1016/j.bmcl.2010.11.015 | ||
11755897 | 9894 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 505 | 7 | 2 | 5 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc3ccccc3c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114838 | 9894 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 505 | 7 | 2 | 5 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc3ccccc3c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10028935 | 110843 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL326808 | 110843 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
11269563 | 141078 | 0 | None | -12 | 5 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL385126 | 141078 | 0 | None | -12 | 5 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
11755897 | 9894 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 505 | 7 | 2 | 5 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc3ccccc3c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114838 | 9894 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 505 | 7 | 2 | 5 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc3ccccc3c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10028935 | 110843 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL326808 | 110843 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
44392460 | 123427 | 0 | None | -11 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 421 | 6 | 1 | 4 | 6.4 | O=C(O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)n1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL362851 | 123427 | 0 | None | -11 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 421 | 6 | 1 | 4 | 6.4 | O=C(O)c1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)n1 | 10.1016/j.bmcl.2004.12.005 | ||
44411890 | 76924 | 0 | None | -36 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 7 | 1 | 3 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c([S+]([O-])Cc3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL208083 | 76924 | 0 | None | -36 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 7 | 1 | 3 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c([S+]([O-])Cc3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
14953120 | 59258 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 372 | 4 | 1 | 3 | 4.8 | O=C(O)[C@H]1CCC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17178 | 59258 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 372 | 4 | 1 | 3 | 4.8 | O=C(O)[C@H]1CCC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
10789142 | 113695 | 0 | None | -190 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 3 | 4 | 4 | 3.1 | CC(=O)Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
CHEMBL332964 | 113695 | 0 | None | -190 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 3 | 4 | 4 | 3.1 | CC(=O)Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
10074701 | 169511 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL444330 | 169511 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1CO2 | 10.1021/jm00096a016 | ||
9978044 | 10008 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1ccc2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
CHEMBL115536 | 10008 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1ccc2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
15025390 | 14630 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 4.8 | O=C(O)c1ccc2c(c1)/C(=C\Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL1206916 | 14630 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 4.8 | O=C(O)c1ccc2c(c1)/C(=C\Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL324972 | 14630 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 4.8 | O=C(O)c1ccc2c(c1)/C(=C\Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10093386 | 112896 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 3 | 1 | 4 | 5.4 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(Cl)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL331833 | 112896 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 3 | 1 | 4 | 5.4 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(Cl)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
71460870 | 82161 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 4.7 | O=C(O)Cc1ccc2c(c1)/C(=C/Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm300682j | ||
CHEMBL2178581 | 82161 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 4.7 | O=C(O)Cc1ccc2c(c1)/C(=C/Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm300682j | ||
10249316 | 71872 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 4.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm058225d | ||
CHEMBL198104 | 71872 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 4.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccccc31)c1ccccc1CO2 | 10.1021/jm058225d | ||
10074701 | 169511 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL444330 | 169511 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.0 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1CO2 | 10.1021/jm00096a016 | ||
14953088 | 98229 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 436 | 6 | 1 | 3 | 5.2 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Br)cc1F | 10.1021/jm00061a008 | ||
CHEMBL277516 | 98229 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 436 | 6 | 1 | 3 | 5.2 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Br)cc1F | 10.1021/jm00061a008 | ||
10406932 | 98559 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00061a008 | ||
CHEMBL280107 | 98559 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccc(F)cc21 | 10.1021/jm00061a008 | ||
9910826 | 65960 | 0 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 434 | 7 | 1 | 3 | 6.9 | O=C(O)Cc1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL184779 | 65960 | 0 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 434 | 7 | 1 | 3 | 6.9 | O=C(O)Cc1cccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
11318288 | 67609 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 516 | 10 | 2 | 5 | 6.2 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)(c3ccccc3)C(F)(F)F)c(CO)oc12 | 10.1021/jm050194z | ||
CHEMBL191118 | 67609 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 516 | 10 | 2 | 5 | 6.2 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)(c3ccccc3)C(F)(F)F)c(CO)oc12 | 10.1021/jm050194z | ||
44338263 | 7246 | 0 | None | -5 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 6 | 1 | 4 | 6.1 | CC(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108616 | 7246 | 0 | None | -5 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 6 | 1 | 4 | 6.1 | CC(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
44338272 | 7767 | 0 | None | -4 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 436 | 7 | 0 | 5 | 5.7 | COC(=O)Cc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108979 | 7767 | 0 | None | -4 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 436 | 7 | 0 | 5 | 5.7 | COC(=O)Cc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
9939791 | 161369 | 0 | None | -125 | 8 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | ||
CHEMBL415310 | 161369 | 0 | None | -125 | 8 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | ||
53324589 | 56519 | 0 | None | -891 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 4.1 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(C(F)(F)F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643775 | 56519 | 0 | None | -891 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 4.1 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(C(F)(F)F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
53317718 | 56534 | 0 | None | -1122 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 510 | 7 | 1 | 4 | 4.8 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643789 | 56534 | 0 | None | -1122 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 510 | 7 | 1 | 4 | 4.8 | O=C(O)Cc1c2n(c3ccccc13)C[C@H](N(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
44364273 | 41982 | 4 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2COC(C2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm8007618 | ||
CHEMBL149724 | 41982 | 4 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@H](O)/C=C/[C@H]1C2COC(C2)[C@@H]1C/C=C\CCCC(=O)O | 10.1021/jm8007618 | ||
14953104 | 97938 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 400 | 6 | 1 | 3 | 4.9 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
CHEMBL275382 | 97938 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 400 | 6 | 1 | 3 | 4.9 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Br)cc1 | 10.1021/jm00061a008 | ||
14953080 | 59955 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 384 | 8 | 1 | 3 | 5.6 | CCC(CC)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17418 | 59955 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 384 | 8 | 1 | 3 | 5.6 | CCC(CC)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
22083972 | 138644 | 0 | None | -1862 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL378744 | 138644 | 0 | None | -1862 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
5581 | 101188 | 10 | None | -7 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm960208o | ||
CHEMBL299175 | 101188 | 10 | None | -7 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm960208o | ||
10742144 | 59345 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 449 | 8 | 2 | 6 | 4.5 | COc1cc(CC2c3cc(O)c(O)cc3CCN2CCc2ccccc2)cc(OC)c1OC | 10.1021/jm950896w | ||
CHEMBL172163 | 59345 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 449 | 8 | 2 | 6 | 4.5 | COc1cc(CC2c3cc(O)c(O)cc3CCN2CCc2ccccc2)cc(OC)c1OC | 10.1021/jm950896w | ||
10074062 | 9857 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 6.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc(-c3ccccc3)c1-c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL114666 | 9857 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 484 | 5 | 1 | 4 | 6.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc(-c3ccccc3)c1-c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
11476788 | 160727 | 0 | None | -1 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL412070 | 160727 | 0 | None | -1 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44591513 | 183515 | 0 | None | -1862 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 420 | 5 | 1 | 4 | 6.0 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482550 | 183515 | 0 | None | -1862 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 420 | 5 | 1 | 4 | 6.0 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10458078 | 109945 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 485 | 8 | 2 | 6 | 4.1 | COc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
CHEMBL324583 | 109945 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 485 | 8 | 2 | 6 | 4.1 | COc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
10023647 | 10766 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1cccc2c1ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
CHEMBL117242 | 10766 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1cccc2c1ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
10051178 | 110169 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 488 | 5 | 2 | 5 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(O)c4ccccc4)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL325868 | 110169 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 488 | 5 | 2 | 5 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(O)c4ccccc4)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
1880 | 2231 | 32 | None | 2 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 10.1016/j.bmcl.2008.03.015 | ||
44450494 | 2231 | 32 | None | 2 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL264421 | 2231 | 32 | None | 2 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 10.1016/j.bmcl.2008.03.015 | ||
10226143 | 95399 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 453 | 4 | 1 | 3 | 6.3 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)cc1)c1c(Br)cc(F)cc12 | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL258968 | 95399 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 453 | 4 | 1 | 3 | 6.3 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)cc1)c1c(Br)cc(F)cc12 | 10.1016/j.bmcl.2008.03.015 | ||
10458078 | 109945 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 485 | 8 | 2 | 6 | 4.1 | COc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
CHEMBL324583 | 109945 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 485 | 8 | 2 | 6 | 4.1 | COc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
10480515 | 183751 | 0 | None | -9 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc(Cl)c1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484327 | 183751 | 0 | None | -9 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc(Cl)c1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
14953077 | 64840 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 360 | 5 | 1 | 3 | 4.5 | CC(C)(Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1)C(=O)O | 10.1021/jm00061a008 | ||
CHEMBL18245 | 64840 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 360 | 5 | 1 | 3 | 4.5 | CC(C)(Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1)C(=O)O | 10.1021/jm00061a008 | ||
10342667 | 184465 | 0 | None | -28 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 430 | 5 | 1 | 6 | 4.3 | Cc1ccc(Sc2c3n(c4nccc(S(C)(=O)=O)c24)CCCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL485535 | 184465 | 0 | None | -28 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 430 | 5 | 1 | 6 | 4.3 | Cc1ccc(Sc2c3n(c4nccc(S(C)(=O)=O)c24)CCCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2009.03.010 | ||
14372505 | 140751 | 0 | None | -61 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL383224 | 140751 | 0 | None | -61 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
5581 | 101188 | 10 | None | -7 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm950896w | ||
CHEMBL299175 | 101188 | 10 | None | -7 | 7 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 345 | 5 | 3 | 6 | 2.6 | COc1cc(CC2NCCc3cc(O)c(O)cc32)cc(OC)c1OC | 10.1021/jm950896w | ||
10051943 | 16149 | 0 | None | -588 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 507 | 2 | 3 | 3 | 3.7 | Oc1cc2c(cc1O)C(Cc1cc(I)cc(I)c1)NCC2 | 10.1021/jm960208o | ||
CHEMBL122757 | 16149 | 0 | None | -588 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 507 | 2 | 3 | 3 | 3.7 | Oc1cc2c(cc1O)C(Cc1cc(I)cc(I)c1)NCC2 | 10.1021/jm960208o | ||
10097814 | 9881 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1ccc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)c(OC)c1OC | 10.1021/jm00096a016 | ||
CHEMBL114785 | 9881 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1ccc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)c(OC)c1OC | 10.1021/jm00096a016 | ||
10319482 | 110106 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 4 | 5.5 | Cc1cc2ncn(CCC3c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL325521 | 110106 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 4 | 5.5 | Cc1cc2ncn(CCC3c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
10097814 | 9881 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1ccc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)c(OC)c1OC | 10.1021/jm00096a016 | ||
CHEMBL114785 | 9881 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1ccc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)c(OC)c1OC | 10.1021/jm00096a016 | ||
44411555 | 76691 | 0 | None | -177 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 5 | 1 | 5 | 5.6 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc3ccc(Cl)cc3n2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207201 | 76691 | 0 | None | -177 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 5 | 1 | 5 | 5.6 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc3ccc(Cl)cc3n2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
11260506 | 67200 | 0 | None | 19 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 476 | 11 | 2 | 5 | 6.0 | CCC(SCCc1c(CO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
CHEMBL189694 | 67200 | 0 | None | 19 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 476 | 11 | 2 | 5 | 6.0 | CCC(SCCc1c(CO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
10024547 | 109998 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4cc(C(=O)O)ccc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL324816 | 109998 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4cc(C(=O)O)ccc43)c2cc1C | 10.1021/jm00096a017 | ||
44411798 | 138532 | 0 | None | -77 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 443 | 6 | 1 | 3 | 5.8 | CC(C)[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL378628 | 138532 | 0 | None | -77 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 443 | 6 | 1 | 3 | 5.8 | CC(C)[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
53317569 | 56527 | 0 | None | -489 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 3.8 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)c(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643782 | 56527 | 0 | None | -489 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 3.8 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)c(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
44591563 | 191311 | 0 | None | -478 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 7.2 | CC(C)c1nccc2c1c(Sc1cc(Cl)c(Cl)cc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL520007 | 191311 | 0 | None | -478 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 7.2 | CC(C)c1nccc2c1c(Sc1cc(Cl)c(Cl)cc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10414389 | 16320 | 0 | None | -120 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 522 | 2 | 4 | 4 | 3.3 | Nc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
CHEMBL123596 | 16320 | 0 | None | -120 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 522 | 2 | 4 | 4 | 3.3 | Nc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
53320595 | 56515 | 0 | None | -407 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)ccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643771 | 56515 | 0 | None | -407 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)ccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
10477535 | 109857 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 426 | 4 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(=O)O)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL324046 | 109857 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 426 | 4 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(=O)O)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
9806791 | 15380 | 0 | None | -1621 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 523 | 2 | 4 | 4 | 3.4 | Oc1cc2c(cc1O)C(Cc1cc(I)c(O)c(I)c1)NCC2 | 10.1021/jm960208o | ||
CHEMBL121964 | 15380 | 0 | None | -1621 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 523 | 2 | 4 | 4 | 3.4 | Oc1cc2c(cc1O)C(Cc1cc(I)c(O)c(I)c1)NCC2 | 10.1021/jm960208o | ||
44450427 | 95316 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 471 | 5 | 1 | 5 | 5.1 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1F)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL258498 | 95316 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 471 | 5 | 1 | 5 | 5.1 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1F)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
10026771 | 113922 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(F)(F)F)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL333159 | 113922 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(F)(F)F)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
15157538 | 138296 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 431 | 4 | 1 | 2 | 6.0 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL378125 | 138296 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 431 | 4 | 1 | 2 | 6.0 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
15157534 | 76378 | 0 | None | 15 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 353 | 4 | 1 | 2 | 5.2 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL206631 | 76378 | 0 | None | 15 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 353 | 4 | 1 | 2 | 5.2 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccccc21 | 10.1016/j.bmcl.2006.02.062 | ||
14372504 | 137758 | 0 | None | -2 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 6.0 | CSc1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL377072 | 137758 | 0 | None | -2 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 6.0 | CSc1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
10251861 | 9960 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 426 | 3 | 1 | 6 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc4c(cc31)OCO4)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL115241 | 9960 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 426 | 3 | 1 | 6 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc4c(cc31)OCO4)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
5311396 | 164698 | 2 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL422964 | 164698 | 2 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
3356 | 2248 | 68 | None | -38 | 8 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
4326 | 2248 | 68 | None | -38 | 8 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
9867642 | 2248 | 68 | None | -38 | 8 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
CHEMBL426559 | 2248 | 68 | None | -38 | 8 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
DB11629 | 2248 | 68 | None | -38 | 8 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | ||
11756528 | 9813 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 523 | 7 | 2 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114363 | 9813 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 523 | 7 | 2 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
11756528 | 9813 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 523 | 7 | 2 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114363 | 9813 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 523 | 7 | 2 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
14953097 | 162705 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 386 | 7 | 1 | 4 | 4.8 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)ccc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL418552 | 162705 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 386 | 7 | 1 | 4 | 4.8 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)ccc32)cc1 | 10.1021/jm00061a008 | ||
44392477 | 64743 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 543 | 6 | 1 | 4 | 8.0 | OC(c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)(C(F)(F)F)C(F)(F)F | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL182367 | 64743 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 543 | 6 | 1 | 4 | 8.0 | OC(c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1)(C(F)(F)F)C(F)(F)F | 10.1016/j.bmcl.2004.12.005 | ||
18476686 | 76173 | 0 | None | -117 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 495 | 5 | 1 | 4 | 5.0 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL206040 | 76173 | 0 | None | -117 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 495 | 5 | 1 | 4 | 5.0 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10297505 | 158733 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 6.6 | CCC(OC)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL409939 | 158733 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 6.6 | CCC(OC)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44338237 | 8080 | 0 | None | -2 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 435 | 6 | 0 | 4 | 5.7 | CN(C)C(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL109189 | 8080 | 0 | None | -2 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 435 | 6 | 0 | 4 | 5.7 | CN(C)C(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
44338236 | 108654 | 0 | None | -1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 442 | 6 | 0 | 5 | 5.4 | CS(=O)(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL321405 | 108654 | 0 | None | -1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 442 | 6 | 0 | 5 | 5.4 | CS(=O)(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
11743676 | 183607 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483159 | 183607 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
3086644 | 64500 | 6 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 6 | 1 | 4 | 4.8 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)cnc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL18197 | 64500 | 6 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 6 | 1 | 4 | 4.8 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)cnc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
44411896 | 76626 | 0 | None | -6 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 417 | 5 | 1 | 4 | 4.3 | CS(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207104 | 76626 | 0 | None | -6 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 417 | 5 | 1 | 4 | 4.3 | CS(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
9874010 | 205461 | 0 | None | -123 | 8 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
CHEMBL92539 | 205461 | 0 | None | -123 | 8 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | ||
53324111 | 56542 | 0 | None | -52 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 466 | 5 | 1 | 4 | 3.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643797 | 56542 | 0 | None | -52 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 466 | 5 | 1 | 4 | 3.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
53319321 | 56531 | 0 | None | -1174 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CCN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643786 | 56531 | 0 | None | -1174 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CCN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
53325908 | 56528 | 0 | None | -1348 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3cccc(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643783 | 56528 | 0 | None | -1348 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3cccc(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
10161062 | 158272 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 449 | 6 | 1 | 4 | 4.6 | CS(=O)(=O)c1cc(F)cc2c1c(CCc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL409451 | 158272 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 449 | 6 | 1 | 4 | 4.6 | CS(=O)(=O)c1cc(F)cc2c1c(CCc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
11306423 | 2489 | 4 | None | -52 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 491 | 6 | 2 | 5 | 6.4 | Clc1ccc(c(c1)c1ccsc1c1cncc(c1)C(C(F)(F)F)(O)O)OCc1ccccc1 | 10.1016/j.bmcl.2004.12.005 | ||
6068 | 2489 | 4 | None | -52 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 491 | 6 | 2 | 5 | 6.4 | Clc1ccc(c(c1)c1ccsc1c1cncc(c1)C(C(F)(F)F)(O)O)OCc1ccccc1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL185346 | 2489 | 4 | None | -52 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 491 | 6 | 2 | 5 | 6.4 | Clc1ccc(c(c1)c1ccsc1c1cncc(c1)C(C(F)(F)F)(O)O)OCc1ccccc1 | 10.1016/j.bmcl.2004.12.005 | ||
44411799 | 77886 | 0 | None | -50 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 586 | 5 | 1 | 6 | 6.3 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc3sc(Cl)c(Cl)c3n2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210744 | 77886 | 0 | None | -50 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 586 | 5 | 1 | 6 | 6.3 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2ccc3sc(Cl)c(Cl)c3n2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
44338326 | 6464 | 0 | None | -38 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 404 | 6 | 0 | 4 | 5.3 | COC(=O)c1ccc(CCc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108289 | 6464 | 0 | None | -38 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 404 | 6 | 0 | 4 | 5.3 | COC(=O)c1ccc(CCc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
10204462 | 96090 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 5.0 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL262869 | 96090 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 453 | 5 | 1 | 5 | 5.0 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
10363348 | 9940 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1ccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
CHEMBL115111 | 9940 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1ccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
14953067 | 61026 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 388 | 7 | 1 | 3 | 5.3 | CC(C)(CCC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17677 | 61026 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 388 | 7 | 1 | 3 | 5.3 | CC(C)(CCC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
14953084 | 162588 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 5.4 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL417820 | 162588 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 5.4 | CC(C)(CC(=O)O)Cc1nc2cc(Cl)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
10254794 | 191619 | 0 | None | -17 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL520480 | 191619 | 0 | None | -17 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
9953978 | 65987 | 0 | None | -14 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 421 | 6 | 1 | 4 | 6.4 | O=C(O)c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL184947 | 65987 | 0 | None | -14 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 421 | 6 | 1 | 4 | 6.4 | O=C(O)c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
22083975 | 137869 | 0 | None | -2 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 446 | 6 | 1 | 4 | 4.1 | CN(C)S(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL377297 | 137869 | 0 | None | -2 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 446 | 6 | 1 | 4 | 4.1 | CN(C)S(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10073359 | 183721 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 468 | 5 | 1 | 6 | 4.7 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(F)cc1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484130 | 183721 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 468 | 5 | 1 | 6 | 4.7 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(F)cc1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10478975 | 161359 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1C=C2 | 10.1021/jm00096a016 | ||
CHEMBL415239 | 161359 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1C=C2 | 10.1021/jm00096a016 | ||
10478975 | 161359 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1C=C2 | 10.1021/jm00096a016 | ||
CHEMBL415239 | 161359 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 451 | 7 | 2 | 4 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1C=C2 | 10.1021/jm00096a016 | ||
10162132 | 95777 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 5.3 | CCS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL260854 | 95777 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 5.3 | CCS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
11166017 | 66803 | 0 | None | -3 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 418 | 9 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CSCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL187544 | 66803 | 0 | None | -3 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 418 | 9 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CSCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
11201307 | 67548 | 0 | None | 21 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 432 | 9 | 1 | 4 | 6.1 | CC(SCCc1coc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
CHEMBL191056 | 67548 | 0 | None | 21 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 432 | 9 | 1 | 4 | 6.1 | CC(SCCc1coc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
44411851 | 77393 | 0 | None | -64 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 545 | 6 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2cccc(OC(F)(F)F)c2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL209033 | 77393 | 0 | None | -64 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 545 | 6 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2cccc(OC(F)(F)F)c2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10116114 | 125365 | 0 | None | -75 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL364841 | 125365 | 0 | None | -75 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
10116114 | 125365 | 0 | None | -75 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL364841 | 125365 | 0 | None | -75 | 8 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | ||
10322452 | 9891 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 469 | 7 | 2 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
CHEMBL114826 | 9891 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 469 | 7 | 2 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
10322452 | 9891 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 469 | 7 | 2 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
CHEMBL114826 | 9891 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 469 | 7 | 2 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc1 | 10.1021/jm00096a016 | ||
10297616 | 95944 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 449 | 6 | 1 | 4 | 7.0 | CSC(C)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL261811 | 95944 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 449 | 6 | 1 | 4 | 7.0 | CSC(C)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44411635 | 77848 | 0 | None | -1 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 539 | 6 | 1 | 6 | 3.8 | CS(=O)(=O)c1ccc(Cn2c3c(c4cc(S(C)(=O)=O)cc(Br)c42)CCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210588 | 77848 | 0 | None | -1 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 539 | 6 | 1 | 6 | 3.8 | CS(=O)(=O)c1ccc(Cn2c3c(c4cc(S(C)(=O)=O)cc(Br)c42)CCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2006.02.062 | ||
10112823 | 95682 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 419 | 5 | 2 | 4 | 5.6 | CC(O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL260400 | 95682 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 419 | 5 | 2 | 4 | 5.6 | CC(O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
10410551 | 109906 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 432 | 3 | 1 | 4 | 5.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc4ccccc4cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL324331 | 109906 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 432 | 3 | 1 | 4 | 5.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc4ccccc4cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
9938626 | 205106 | 0 | None | -177 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
CHEMBL90491 | 205106 | 0 | None | -177 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
11741746 | 183631 | 0 | None | -3981 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 5 | 1 | 4 | 5.9 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483346 | 183631 | 0 | None | -3981 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 5 | 1 | 4 | 5.9 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
53320618 | 56546 | 0 | None | -446 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 3.6 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(Cl)s1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643801 | 56546 | 0 | None | -446 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 3.6 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(Cl)s1 | 10.1016/j.bmcl.2010.11.015 | ||
44450410 | 155858 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL406649 | 155858 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
53320616 | 56522 | 0 | None | -1202 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 492 | 6 | 1 | 4 | 4.7 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(-c4ccccc4)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643778 | 56522 | 0 | None | -1202 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 492 | 6 | 1 | 4 | 4.7 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(-c4ccccc4)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
10407599 | 10547 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 383 | 3 | 1 | 5 | 4.2 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ncccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL117036 | 10547 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 383 | 3 | 1 | 5 | 4.2 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ncccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
44591458 | 179419 | 0 | None | -213 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 5.5 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1cnccc12 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL474702 | 179419 | 0 | None | -213 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 5.5 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1cnccc12 | 10.1016/j.bmcl.2009.03.010 | ||
10454345 | 9808 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.8 | COc1ccc2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
CHEMBL114335 | 9808 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.8 | COc1ccc2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
11744062 | 9785 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1OC | 10.1021/jm00096a017 | ||
CHEMBL114213 | 9785 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1OC | 10.1021/jm00096a017 | ||
9978920 | 9955 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1ccc2c(ncn2C/C=C2\c3ccccc3COc3ccc(C(=O)O)cc32)c1C | 10.1021/jm00096a017 | ||
CHEMBL115224 | 9955 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1ccc2c(ncn2C/C=C2\c3ccccc3COc3ccc(C(=O)O)cc32)c1C | 10.1021/jm00096a017 | ||
10050461 | 9903 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CS2 | 10.1021/jm00096a016 | ||
CHEMBL114901 | 9903 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CS2 | 10.1021/jm00096a016 | ||
10050461 | 9903 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CS2 | 10.1021/jm00096a016 | ||
CHEMBL114901 | 9903 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CS2 | 10.1021/jm00096a016 | ||
10074101 | 183513 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)cc1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482547 | 183513 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)cc1Cl)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10364232 | 110020 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc(C)c2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
CHEMBL324965 | 110020 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc(C)c2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
10026942 | 9845 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 453 | 7 | 2 | 4 | 4.3 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CC2 | 10.1021/jm00096a016 | ||
CHEMBL114588 | 9845 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 453 | 7 | 2 | 4 | 4.3 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CC2 | 10.1021/jm00096a016 | ||
10071103 | 10406 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 426 | 4 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(=O)O)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL116721 | 10406 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 426 | 4 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(=O)O)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10026942 | 9845 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 453 | 7 | 2 | 4 | 4.3 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CC2 | 10.1021/jm00096a016 | ||
CHEMBL114588 | 9845 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 453 | 7 | 2 | 4 | 4.3 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CC2 | 10.1021/jm00096a016 | ||
9809136 | 106406 | 0 | None | -301 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
CHEMBL314533 | 106406 | 0 | None | -301 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | ||
9802748 | 135400 | 0 | None | -1584 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CN([C@@H]1CCc2c(c3ccccc3n2CCC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | ||
CHEMBL373118 | 135400 | 0 | None | -1584 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.4 | CN([C@@H]1CCc2c(c3ccccc3n2CCC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | ||
14953103 | 62848 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 352 | 7 | 1 | 4 | 4.1 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3ccccc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17899 | 62848 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 352 | 7 | 1 | 4 | 4.1 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3ccccc32)cc1 | 10.1021/jm00061a008 | ||
14953078 | 98268 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 6 | 1 | 3 | 4.8 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL277826 | 98268 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 356 | 6 | 1 | 3 | 4.8 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
44450397 | 95690 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 463 | 5 | 1 | 4 | 5.5 | CS(=O)(=O)c1cc(F)cc2c1c(-c1cccc(-c3ccccc3)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL260468 | 95690 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 463 | 5 | 1 | 4 | 5.5 | CS(=O)(=O)c1cc(F)cc2c1c(-c1cccc(-c3ccccc3)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
11316066 | 66973 | 0 | None | 1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 418 | 9 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL188384 | 66973 | 0 | None | 1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 418 | 9 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
44338291 | 6354 | 0 | None | -3 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 6 | 0 | 5 | 4.8 | COC(=O)c1ccc(C[S+]([O-])c2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108242 | 6354 | 0 | None | -3 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 6 | 0 | 5 | 4.8 | COC(=O)c1ccc(C[S+]([O-])c2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
11350967 | 66851 | 0 | None | -11 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.4 | O=C(O)COc1cccc2c(CCCSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL187758 | 66851 | 0 | None | -11 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.4 | O=C(O)COc1cccc2c(CCCSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
11750835 | 67110 | 0 | None | -5 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.4 | O=C(O)COc1cccc2c(CSCCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL189063 | 67110 | 0 | None | -5 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.4 | O=C(O)COc1cccc2c(CSCCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
11407826 | 123129 | 0 | None | -38 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CCSCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL361939 | 123129 | 0 | None | -38 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 432 | 10 | 1 | 4 | 6.0 | O=C(O)COc1cccc2c(CCSCC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
11545879 | 14737 | 2 | None | -125 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
CHEMBL1207973 | 14737 | 2 | None | -125 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
CHEMBL467510 | 14737 | 2 | None | -125 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 381 | 6 | 1 | 3 | 5.8 | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 | 10.1016/j.bmcl.2008.11.032 | ||
10225820 | 155857 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 449 | 5 | 1 | 4 | 5.0 | CC(c1ccc(Cl)cc1)c1c2n(c3cc(F)cc(S(C)(=O)=O)c13)CCC2CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL406648 | 155857 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 449 | 5 | 1 | 4 | 5.0 | CC(c1ccc(Cl)cc1)c1c2n(c3cc(F)cc(S(C)(=O)=O)c13)CCC2CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
3078928 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324130 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
3078928 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL324130 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
3078928 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324130 | 109876 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 455 | 7 | 2 | 5 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10412393 | 9826 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 469 | 7 | 1 | 5 | 4.4 | CN(CCSC1c2ccccc2COc2ccc(C(=O)O)cc21)S(=O)(=O)c1ccccc1 | 10.1021/jm00096a016 | ||
CHEMBL114424 | 9826 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 469 | 7 | 1 | 5 | 4.4 | CN(CCSC1c2ccccc2COc2ccc(C(=O)O)cc21)S(=O)(=O)c1ccccc1 | 10.1021/jm00096a016 | ||
10412393 | 9826 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 469 | 7 | 1 | 5 | 4.4 | CN(CCSC1c2ccccc2COc2ccc(C(=O)O)cc21)S(=O)(=O)c1ccccc1 | 10.1021/jm00096a016 | ||
CHEMBL114424 | 9826 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 469 | 7 | 1 | 5 | 4.4 | CN(CCSC1c2ccccc2COc2ccc(C(=O)O)cc21)S(=O)(=O)c1ccccc1 | 10.1021/jm00096a016 | ||
44411605 | 76845 | 0 | None | -117 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 499 | 6 | 1 | 4 | 6.3 | CS(=O)(=O)c1cc(C2CCCCC2)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207916 | 76845 | 0 | None | -117 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 499 | 6 | 1 | 4 | 6.3 | CS(=O)(=O)c1cc(C2CCCCC2)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10495597 | 58971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 316 | 3 | 4 | 6 | 2.1 | O=[N+]([O-])c1cc(CC2NCCc3cc(O)c(O)cc32)ccc1O | 10.1021/jm950896w | ||
CHEMBL170451 | 58971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 316 | 3 | 4 | 6 | 2.1 | O=[N+]([O-])c1cc(CC2NCCc3cc(O)c(O)cc32)ccc1O | 10.1021/jm950896w | ||
44591806 | 183572 | 0 | None | -3 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 402 | 5 | 1 | 5 | 5.2 | COc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482953 | 183572 | 0 | None | -3 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 402 | 5 | 1 | 5 | 5.2 | COc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
44411797 | 138985 | 0 | None | -85 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 429 | 6 | 1 | 3 | 5.4 | CC[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL379491 | 138985 | 0 | None | -85 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 429 | 6 | 1 | 3 | 5.4 | CC[S+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
46890180 | 6598 | 0 | None | -97 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 510 | 7 | 1 | 5 | 4.9 | Cc1c(C2c3ccccc3S(=O)(=O)N2CCOc2ccc(Cl)cc2)c2ccccc2n1CC(=O)O | 10.1016/j.bmcl.2010.04.046 | ||
CHEMBL1083446 | 6598 | 0 | None | -97 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 510 | 7 | 1 | 5 | 4.9 | Cc1c(C2c3ccccc3S(=O)(=O)N2CCOc2ccc(Cl)cc2)c2ccccc2n1CC(=O)O | 10.1016/j.bmcl.2010.04.046 | ||
44591535 | 183606 | 0 | None | -4677 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 446 | 6 | 1 | 4 | 6.4 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(CC3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483154 | 183606 | 0 | None | -4677 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 446 | 6 | 1 | 4 | 6.4 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(CC3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
10683471 | 59583 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 270 | 2 | 4 | 4 | 2.1 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
CHEMBL173039 | 59583 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 270 | 2 | 4 | 4 | 2.1 | Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
10345671 | 183697 | 0 | None | -10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 494 | 5 | 1 | 6 | 4.7 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Br)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483939 | 183697 | 0 | None | -10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 494 | 5 | 1 | 6 | 4.7 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Br)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10349225 | 16207 | 0 | None | -40 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 564 | 3 | 4 | 4 | 3.7 | CC(=O)Nc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
CHEMBL122992 | 16207 | 0 | None | -40 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 564 | 3 | 4 | 4 | 3.7 | CC(=O)Nc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
44392512 | 64893 | 0 | None | -6 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 432 | 6 | 1 | 5 | 6.3 | N#CC(O)c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL182623 | 64893 | 0 | None | -6 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 432 | 6 | 1 | 5 | 6.3 | N#CC(O)c1cncc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
9933925 | 139031 | 0 | None | -380 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL379711 | 139031 | 0 | None | -380 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 459 | 6 | 1 | 5 | 4.5 | CC(=O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
10114504 | 95349 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 445 | 7 | 1 | 3 | 7.5 | CCC(CC)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL258714 | 95349 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 445 | 7 | 1 | 3 | 7.5 | CCC(CC)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
10409168 | 110658 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 408 | 4 | 1 | 4 | 5.3 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc(-c3ccccc3)c1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL326393 | 110658 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 408 | 4 | 1 | 4 | 5.3 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc(-c3ccccc3)c1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
14953098 | 162613 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 418 | 7 | 1 | 5 | 3.7 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(S(C)(=O)=O)cc1 | 10.1021/jm00061a008 | ||
CHEMBL418000 | 162613 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 418 | 7 | 1 | 5 | 3.7 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(S(C)(=O)=O)cc1 | 10.1021/jm00061a008 | ||
44411889 | 76923 | 0 | None | -131 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 424 | 5 | 1 | 3 | 4.9 | CN(C)C(=O)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL208082 | 76923 | 0 | None | -131 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 424 | 5 | 1 | 3 | 4.9 | CN(C)C(=O)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
44338285 | 7394 | 0 | None | -12 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CC(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108698 | 7394 | 0 | None | -12 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CC(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
45268455 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL561132 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
45268455 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.084 | ||
CHEMBL561132 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.084 | ||
45268455 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | nan | ||
CHEMBL561132 | 194463 | 39 | None | -1513 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | nan | ||
10433093 | 183948 | 0 | None | -1000 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484779 | 183948 | 0 | None | -1000 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
15947857 | 154975 | 8 | None | -34 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | ||
CHEMBL404199 | 154975 | 8 | None | -34 | 7 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | ||
14953114 | 63152 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 357 | 6 | 1 | 4 | 4.2 | CC(C)(CC(=O)O)Cc1nc2cccnc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17990 | 63152 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 357 | 6 | 1 | 4 | 4.2 | CC(C)(CC(=O)O)Cc1nc2cccnc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
9825028 | 183787 | 0 | None | -9 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 4.6 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484525 | 183787 | 0 | None | -9 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 4.6 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
11374485 | 78559 | 0 | None | -32 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 455 | 6 | 1 | 4 | 6.0 | NS(=O)(=O)c1cccc(-c2ccsc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
CHEMBL2113029 | 78559 | 0 | None | -32 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 455 | 6 | 1 | 4 | 6.0 | NS(=O)(=O)c1cccc(-c2ccsc2-c2cc(Cl)ccc2OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.12.005 | ||
53317958 | 56518 | 0 | None | -3630 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 450 | 5 | 1 | 4 | 3.7 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643774 | 56518 | 0 | None | -3630 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 450 | 5 | 1 | 4 | 3.7 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(Cl)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
10386146 | 9747 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 398 | 3 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1c(O)nc3ccccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL114034 | 9747 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 398 | 3 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1c(O)nc3ccccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
14953090 | 98173 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 370 | 7 | 1 | 4 | 4.3 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(F)ccc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL277065 | 98173 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 370 | 7 | 1 | 4 | 4.3 | COc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(F)ccc32)cc1 | 10.1021/jm00061a008 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
11237257 | 67265 | 0 | None | 446 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 494 | 10 | 2 | 6 | 4.3 | CC(c1ccccc1)(c1ccccc1)S(=O)(=O)CCc1c(CO)oc2c(OCC(=O)O)cccc12 | 10.1021/jm050194z | ||
CHEMBL190288 | 67265 | 0 | None | 446 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 494 | 10 | 2 | 6 | 4.3 | CC(c1ccccc1)(c1ccccc1)S(=O)(=O)CCc1c(CO)oc2c(OCC(=O)O)cccc12 | 10.1021/jm050194z | ||
123879 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1910 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
1911 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
2354 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
CHEMBL361812 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
DB13036 | 3235 | 77 | None | 3 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 10.1021/jm049036i | ||
11261579 | 67257 | 0 | None | 117 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 10 | 2 | 5 | 5.6 | CC(SCCc1c(CO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
CHEMBL190236 | 67257 | 0 | None | 117 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 10 | 2 | 5 | 5.6 | CC(SCCc1c(CO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
11743212 | 16982 | 0 | None | -131 | 7 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | ||
CHEMBL125588 | 16982 | 0 | None | -131 | 7 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | ||
44338297 | 108153 | 0 | None | 1 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 390 | 5 | 0 | 4 | 5.1 | COC(=O)c1ccc(Cc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL320734 | 108153 | 0 | None | 1 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 390 | 5 | 0 | 4 | 5.1 | COC(=O)c1ccc(Cc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
44591762 | 191223 | 0 | None | -26 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 466 | 5 | 1 | 6 | 5.1 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc3ccccc13)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL519862 | 191223 | 0 | None | -26 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 466 | 5 | 1 | 6 | 5.1 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc3ccccc13)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
44591515 | 183548 | 0 | None | -524 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 432 | 5 | 1 | 4 | 6.3 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(C3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482744 | 183548 | 0 | None | -524 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 432 | 5 | 1 | 4 | 6.3 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(C3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
15680093 | 64515 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 400 | 6 | 1 | 3 | 5.5 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CCCC1 | 10.1021/jm00061a008 | ||
CHEMBL18206 | 64515 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 400 | 6 | 1 | 3 | 5.5 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CCCC1 | 10.1021/jm00061a008 | ||
40517075 | 9167 | 1 | None | 1 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 364 | 5 | 0 | 3 | 6.0 | Clc1ccc(Cn2c(SCc3ccccc3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL110774 | 9167 | 1 | None | 1 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 364 | 5 | 0 | 3 | 6.0 | Clc1ccc(Cn2c(SCc3ccccc3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
53323266 | 56529 | 0 | None | -107 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)cc(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643784 | 56529 | 0 | None | -107 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)cc(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
10364780 | 110145 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 6 | 2 | 4 | 4.5 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL325743 | 110145 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 6 | 2 | 4 | 4.5 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10364780 | 110145 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 6 | 2 | 4 | 4.5 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL325743 | 110145 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 6 | 2 | 4 | 4.5 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10092137 | 109838 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1cccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c12 | 10.1021/jm00096a017 | ||
CHEMBL323926 | 109838 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.1 | Cc1cccc2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c12 | 10.1021/jm00096a017 | ||
10430971 | 164779 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 398 | 3 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3c(O)cccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL423511 | 164779 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 398 | 3 | 2 | 5 | 4.5 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3c(O)cccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10136760 | 159074 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 417 | 5 | 1 | 3 | 6.7 | CC(C)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL410338 | 159074 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 417 | 5 | 1 | 3 | 6.7 | CC(C)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
9871887 | 102725 | 0 | None | -22 | 4 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 537 | 3 | 3 | 4 | 3.7 | COc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
CHEMBL308351 | 102725 | 0 | None | -22 | 4 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 537 | 3 | 3 | 4 | 3.7 | COc1c(I)cc(CC2NCCc3cc(O)c(O)cc32)cc1I | 10.1021/jm960208o | ||
44591537 | 190634 | 0 | None | -537 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 448 | 5 | 1 | 4 | 7.0 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL518988 | 190634 | 0 | None | -537 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 448 | 5 | 1 | 4 | 7.0 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10095579 | 100861 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 456 | 7 | 2 | 6 | 3.5 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccnc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL296720 | 100861 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 456 | 7 | 2 | 6 | 3.5 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccnc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
9801972 | 77784 | 0 | None | -25 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S@@+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210356 | 77784 | 0 | None | -25 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 415 | 5 | 1 | 3 | 5.0 | C[S@@+]([O-])c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
10095579 | 100861 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 456 | 7 | 2 | 6 | 3.5 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccnc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL296720 | 100861 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 456 | 7 | 2 | 6 | 3.5 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccnc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10476586 | 8062 | 0 | None | -1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 408 | 6 | 1 | 4 | 5.7 | O=C(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL109179 | 8062 | 0 | None | -1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 408 | 6 | 1 | 4 | 5.7 | O=C(O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
10204113 | 95553 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 447 | 6 | 2 | 4 | 6.2 | CC(C)C(O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL259650 | 95553 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 447 | 6 | 2 | 4 | 6.2 | CC(C)C(O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
14953087 | 162738 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 386 | 7 | 1 | 4 | 5.0 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(F)ccc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL418730 | 162738 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 386 | 7 | 1 | 4 | 5.0 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(F)ccc32)cc1 | 10.1021/jm00061a008 | ||
9980414 | 109891 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 6 | 3 | 5 | 4.2 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1O)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324256 | 109891 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 6 | 3 | 5 | 4.2 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1O)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
44411688 | 77815 | 0 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 4.6 | CS(=O)(=O)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210471 | 77815 | 0 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 4.6 | CS(=O)(=O)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
9980414 | 109891 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 6 | 3 | 5 | 4.2 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1O)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324256 | 109891 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 6 | 3 | 5 | 4.2 | O=C(O)c1ccc2c(c1)C(SCCNC(=O)c1ccccc1O)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
1888 | 3837 | 26 | None | 2 | 17 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10.1021/np50094a001 | ||
1974 | 3837 | 26 | None | 2 | 17 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10.1021/np50094a001 | ||
5311493 | 3837 | 26 | None | 2 | 17 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10.1021/np50094a001 | ||
CHEMBL521784 | 3837 | 26 | None | 2 | 17 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10.1021/np50094a001 | ||
3078925 | 110247 | 6 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccs1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL326047 | 110247 | 6 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccs1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
3078925 | 110247 | 6 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccs1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL326047 | 110247 | 6 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 4.1 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1cccs1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
24765153 | 183947 | 0 | None | -7762 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484778 | 183947 | 0 | None | -7762 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
11202399 | 126314 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 478 | 10 | 2 | 5 | 4.6 | CC(c1ccccc1)(c1ccccc1)[S+]([O-])CCc1c(CO)oc2c(OCC(=O)O)cccc12 | 10.1021/jm050194z | ||
CHEMBL365501 | 126314 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 478 | 10 | 2 | 5 | 4.6 | CC(c1ccccc1)(c1ccccc1)[S+]([O-])CCc1c(CO)oc2c(OCC(=O)O)cccc12 | 10.1021/jm050194z | ||
44271957 | 63544 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 384 | 4 | 1 | 3 | 5.0 | O=C(O)[C@@H]1CC=CC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL18037 | 63544 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 384 | 4 | 1 | 3 | 5.0 | O=C(O)[C@@H]1CC=CC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
11292620 | 68850 | 0 | None | -1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 404 | 8 | 1 | 4 | 5.9 | O=C(O)COc1cccc2c(CSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
CHEMBL192661 | 68850 | 0 | None | -1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 404 | 8 | 1 | 4 | 5.9 | O=C(O)COc1cccc2c(CSC(c3ccccc3)c3ccccc3)coc12 | 10.1021/jm050194z | ||
10276571 | 158540 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL409737 | 158540 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
14953073 | 64681 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 372 | 6 | 1 | 3 | 4.7 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CC1 | 10.1021/jm00061a008 | ||
CHEMBL18232 | 64681 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 372 | 6 | 1 | 3 | 4.7 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CC1 | 10.1021/jm00061a008 | ||
11270709 | 137736 | 0 | None | -144 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 443 | 6 | 1 | 4 | 4.9 | C=Cc1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL377055 | 137736 | 0 | None | -144 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 443 | 6 | 1 | 4 | 4.9 | C=Cc1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
10456444 | 9849 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(Cl)c(Cl)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL114614 | 9849 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(Cl)c(Cl)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
5036 | 101094 | 22 | None | -9 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | O=C(O)CCn1c2c(c3ccccc31)CC(NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL298483 | 101094 | 22 | None | -9 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 416 | 6 | 2 | 4 | 3.1 | O=C(O)CCn1c2c(c3ccccc31)CC(NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2010.11.015 | ||
10577317 | 15337 | 0 | None | -2691 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 4 | 4 | 4 | 4.4 | O=C(Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I)c1ccccc1 | 10.1021/jm960208o | ||
CHEMBL121704 | 15337 | 0 | None | -2691 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 4 | 4 | 4 | 4.4 | O=C(Nc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1I)c1ccccc1 | 10.1021/jm960208o | ||
11545850 | 69893 | 0 | None | -1047 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1021/jm049036i | ||
CHEMBL194085 | 69893 | 0 | None | -1047 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 402 | 5 | 2 | 4 | 2.7 | O=C(O)Cn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2 | 10.1021/jm049036i | ||
14953076 | 97838 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 332 | 5 | 1 | 3 | 3.9 | O=C(O)CCc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL274749 | 97838 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 332 | 5 | 1 | 3 | 3.9 | O=C(O)CCc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
10276868 | 158273 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 469 | 5 | 1 | 5 | 5.5 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc3ccccc3c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL409452 | 158273 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 469 | 5 | 1 | 5 | 5.5 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc3ccccc3c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44591516 | 183604 | 0 | None | -588 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 460 | 6 | 1 | 4 | 6.8 | O=C(O)CC1CCCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(CC3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483152 | 183604 | 0 | None | -588 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 460 | 6 | 1 | 4 | 6.8 | O=C(O)CC1CCCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(CC3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
11742673 | 110025 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 416 | 3 | 1 | 4 | 5.4 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(Cl)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL325032 | 110025 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 416 | 3 | 1 | 4 | 5.4 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(Cl)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
14953093 | 63176 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 402 | 7 | 1 | 4 | 5.5 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)ccc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL18000 | 63176 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 402 | 7 | 1 | 4 | 5.5 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)ccc32)cc1 | 10.1021/jm00061a008 | ||
14953086 | 64882 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.6 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm00061a008 | ||
CHEMBL18257 | 64882 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 408 | 6 | 1 | 3 | 5.6 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)c(Cl)c1 | 10.1021/jm00061a008 | ||
10253895 | 9805 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 464 | 7 | 3 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCC/N=C(\S)NCc1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114324 | 9805 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 464 | 7 | 3 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCC/N=C(\S)NCc1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
11744063 | 9733 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc(OC)c2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
CHEMBL113944 | 9733 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc(OC)c2c(c1)ncn2C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00096a017 | ||
10480645 | 11034 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 5 | 2 | 5 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(O)c4ccccc4)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL117821 | 11034 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 5 | 2 | 5 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(C(O)c4ccccc4)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10253895 | 9805 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 464 | 7 | 3 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCC/N=C(\S)NCc1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114324 | 9805 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 464 | 7 | 3 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCC/N=C(\S)NCc1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
10480363 | 109908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL324364 | 109908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 8 | 2 | 5 | 4.7 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)/C=C/c1ccccc1)c1ccccc1CO2 | 10.1021/jm00096a016 | ||
44411791 | 77717 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 5.1 | O=Cc1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210045 | 77717 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 5.1 | O=Cc1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
3078923 | 9764 | 5 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1cc(Br)ccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114102 | 9764 | 5 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1cc(Br)ccc1CO2 | 10.1021/jm00096a016 | ||
3078923 | 9764 | 5 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1cc(Br)ccc1CO2 | 10.1021/jm00096a016 | ||
CHEMBL114102 | 9764 | 5 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 4.8 | O=C(O)c1ccc2c(c1)C(SCCNS(=O)(=O)c1ccccc1)c1cc(Br)ccc1CO2 | 10.1021/jm00096a016 | ||
10456399 | 9789 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(F)(F)F)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL114257 | 9789 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 450 | 3 | 1 | 4 | 5.8 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(C(F)(F)F)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
14953106 | 63010 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 367 | 7 | 1 | 5 | 4.0 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc([N+](=O)[O-])cc1 | 10.1021/jm00061a008 | ||
CHEMBL17941 | 63010 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 367 | 7 | 1 | 5 | 4.0 | CC(C)(CC(=O)O)Cc1nc2ccccc2n1Cc1ccc([N+](=O)[O-])cc1 | 10.1021/jm00061a008 | ||
10359399 | 10424 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 332 | 3 | 1 | 4 | 3.6 | O=C(O)c1ccc2c(c1)/C(=C/Cn1ccnc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL116869 | 10424 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 332 | 3 | 1 | 4 | 3.6 | O=C(O)c1ccc2c(c1)/C(=C/Cn1ccnc1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
44338319 | 7128 | 0 | None | -5 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 6 | 1 | 5 | 5.1 | COC(=O)c1ccc(CNc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108564 | 7128 | 0 | None | -5 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 6 | 1 | 5 | 5.1 | COC(=O)c1ccc(CNc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
9917280 | 14371 | 0 | None | -39810 | 2 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 633 | 2 | 3 | 3 | 4.3 | Oc1cc2c(cc1O)C(Cc1cc(I)c(I)c(I)c1)NCC2 | 10.1021/jm960208o | ||
CHEMBL120278 | 14371 | 0 | None | -39810 | 2 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 633 | 2 | 3 | 3 | 4.3 | Oc1cc2c(cc1O)C(Cc1cc(I)c(I)c(I)c1)NCC2 | 10.1021/jm960208o | ||
50898361 | 56578 | 0 | None | -48 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 549 | 7 | 2 | 5 | 5.4 | Cc1ccc(S(=O)(=O)NC(=O)NCCc2ccc(-c3c(C(=O)N(C)C)sc4c(C)cc(C)cc34)cc2)cc1 | 10.1016/j.bmcl.2010.11.118 | ||
CHEMBL1644003 | 56578 | 0 | None | -48 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 549 | 7 | 2 | 5 | 5.4 | Cc1ccc(S(=O)(=O)NC(=O)NCCc2ccc(-c3c(C(=O)N(C)C)sc4c(C)cc(C)cc34)cc2)cc1 | 10.1016/j.bmcl.2010.11.118 | ||
23964891 | 7374 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 382 | 5 | 0 | 3 | 6.2 | Fc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108678 | 7374 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 382 | 5 | 0 | 3 | 6.2 | Fc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
44591562 | 183946 | 0 | None | -9120 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.3 | CC(C)c1nccc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL484777 | 183946 | 0 | None | -9120 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.3 | CC(C)c1nccc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
44331597 | 206660 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 737 | 20 | 6 | 8 | 4.0 | [N-]=[N+]=Nc1ccc(CCCC(=O)NCC(=O)NCC2C3CCC(O3)C2C/C=C\CCCC(=O)NNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)cc1 | 10.1016/s0960-894x(99)00511-9 | ||
CHEMBL99695 | 206660 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 737 | 20 | 6 | 8 | 4.0 | [N-]=[N+]=Nc1ccc(CCCC(=O)NCC(=O)NCC2C3CCC(O3)C2C/C=C\CCCC(=O)NNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)cc1 | 10.1016/s0960-894x(99)00511-9 | ||
44591536 | 190633 | 0 | None | -549 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 6 | 1 | 4 | 6.8 | CCCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL518987 | 190633 | 0 | None | -549 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 6 | 1 | 4 | 6.8 | CCCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10251769 | 9883 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 424 | 4 | 1 | 4 | 5.3 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(CC(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL114798 | 9883 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 424 | 4 | 1 | 4 | 5.3 | Cc1cc2ncn(C/C=C3\c4ccccc4COc4ccc(CC(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
1986 | 1285 | 46 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00096a017 | ||
54343 | 1285 | 46 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00096a017 | ||
CHEMBL71685 | 1285 | 46 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 10.1021/jm00096a017 | ||
15948325 | 2490 | 39 | None | -512 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
5856 | 2490 | 39 | None | -512 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
CHEMBL402162 | 2490 | 39 | None | -512 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | ||
10047167 | 78058 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
CHEMBL2111756 | 78058 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.4 | Cc1cc2ncn(C/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)c2cc1C | 10.1021/jm00096a017 | ||
10458032 | 191621 | 0 | None | -17 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.0 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL520481 | 191621 | 0 | None | -17 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.0 | CS(=O)(=O)c1ccnc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
11742649 | 183547 | 0 | None | -39 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccnc2c1c(Sc1ccccc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482743 | 183547 | 0 | None | -39 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccnc2c1c(Sc1ccccc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
53326879 | 56516 | 0 | None | -5 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 494 | 6 | 1 | 6 | 2.4 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(S(C)(=O)=O)ccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | nan | ||
CHEMBL1643772 | 56516 | 0 | None | -5 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 494 | 6 | 1 | 6 | 2.4 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(S(C)(=O)=O)ccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | nan | ||
51550 | 204036 | 9 | None | -11 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00061a008 | ||
CHEMBL8273 | 204036 | 9 | None | -11 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 335 | 8 | 2 | 4 | 1.7 | O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1 | 10.1021/jm00061a008 | ||
14953071 | 97801 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 378 | 5 | 1 | 4 | 4.8 | CC(C)(Sc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1)C(=O)O | 10.1021/jm00061a008 | ||
CHEMBL274485 | 97801 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 378 | 5 | 1 | 4 | 4.8 | CC(C)(Sc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1)C(=O)O | 10.1021/jm00061a008 | ||
25003075 | 6760 | 12 | None | -23988 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | ||
CHEMBL1084009 | 6760 | 12 | None | -23988 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | ||
10158956 | 95884 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 417 | 5 | 1 | 4 | 5.8 | CC(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL261471 | 95884 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 417 | 5 | 1 | 4 | 5.8 | CC(=O)c1cc(F)cc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44450496 | 159403 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 477 | 5 | 1 | 5 | 4.8 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCCCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL410736 | 159403 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 477 | 5 | 1 | 5 | 4.8 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCCCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
25817650 | 62864 | 1 | None | -7244 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL179036 | 62864 | 1 | None | -7244 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
44591512 | 191951 | 0 | None | -691 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.4 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL521122 | 191951 | 0 | None | -691 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.4 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10344683 | 188275 | 0 | None | -4897 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 470 | 5 | 1 | 6 | 4.9 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL506909 | 188275 | 0 | None | -4897 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 470 | 5 | 1 | 6 | 4.9 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
10225819 | 95802 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 449 | 5 | 1 | 5 | 4.0 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL261008 | 95802 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 449 | 5 | 1 | 5 | 4.0 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
44591457 | 188480 | 0 | None | -8 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 414 | 5 | 1 | 4 | 6.3 | CC(C)c1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL509685 | 188480 | 0 | None | -8 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 414 | 5 | 1 | 4 | 6.3 | CC(C)c1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
14953115 | 98457 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 403 | 7 | 1 | 5 | 4.9 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)cnc32)cc1 | 10.1021/jm00061a008 | ||
CHEMBL279348 | 98457 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 403 | 7 | 1 | 5 | 4.9 | CSc1ccc(Cn2c(CC(C)(C)CC(=O)O)nc3cc(Cl)cnc32)cc1 | 10.1021/jm00061a008 | ||
10251338 | 110847 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 416 | 5 | 2 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCc1nc3ccccc3[nH]1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL326856 | 110847 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 416 | 5 | 2 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCc1nc3ccccc3[nH]1)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10366462 | 9835 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 5.0 | O=C(NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21)OCc1ccccc1 | 10.1021/jm00096a016 | ||
CHEMBL114473 | 9835 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 5.0 | O=C(NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21)OCc1ccccc1 | 10.1021/jm00096a016 | ||
10366462 | 9835 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 5.0 | O=C(NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21)OCc1ccccc1 | 10.1021/jm00096a016 | ||
CHEMBL114473 | 9835 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 449 | 7 | 2 | 5 | 5.0 | O=C(NCCSC1c2ccccc2COc2ccc(C(=O)O)cc21)OCc1ccccc1 | 10.1021/jm00096a016 | ||
44411809 | 77018 | 0 | None | 2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 2 | 3 | 4.7 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(CO)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL208596 | 77018 | 0 | None | 2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 2 | 3 | 4.7 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(CO)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
14953072 | 98364 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 374 | 6 | 1 | 3 | 4.9 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL278653 | 98364 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 374 | 6 | 1 | 3 | 4.9 | CC(C)(CC(=O)O)Cc1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
44338292 | 6355 | 0 | None | -2 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 376 | 4 | 0 | 4 | 5.2 | COC(=O)c1ccc(-c2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL108243 | 6355 | 0 | None | -2 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 376 | 4 | 0 | 4 | 5.2 | COC(=O)c1ccc(-c2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
11294166 | 76692 | 0 | None | -3890 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207203 | 76692 | 0 | None | -3890 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1016/j.bmcl.2006.02.062 | ||
11294166 | 76692 | 0 | None | -3890 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
CHEMBL207203 | 76692 | 0 | None | -3890 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 461 | 6 | 2 | 5 | 4.3 | CC(O)c1cc(S(C)(=O)=O)cc2c3c(n(Cc4ccc(Cl)cc4)c12)[C@@H](CC(=O)O)CC3 | 10.1021/jm0603668 | ||
44450497 | 160007 | 0 | None | -3 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
CHEMBL411255 | 160007 | 0 | None | -3 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | ||
53316671 | 56523 | 0 | None | -288 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)c(F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643779 | 56523 | 0 | None | -288 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3cc(F)c(F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
11454655 | 67431 | 0 | None | 79 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 490 | 12 | 2 | 5 | 6.1 | CC(SCCc1c(CCCO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
CHEMBL190840 | 67431 | 0 | None | 79 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 490 | 12 | 2 | 5 | 6.1 | CC(SCCc1c(CCCO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
53317957 | 56517 | 0 | None | -660 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643773 | 56517 | 0 | None | -660 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(F)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
22083978 | 76773 | 0 | None | -162 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 499 | 6 | 1 | 5 | 6.0 | CS(=O)(=O)c1cc(-c2cccs2)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL207689 | 76773 | 0 | None | -162 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 499 | 6 | 1 | 5 | 6.0 | CS(=O)(=O)c1cc(-c2cccs2)c2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
71450058 | 82162 | 0 | None | -37 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCCC(Cc3ccccc3)C1)c1ccccc1CO2 | 10.1021/jm300682j | ||
CHEMBL2178582 | 82162 | 0 | None | -37 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCCC(Cc3ccccc3)C1)c1ccccc1CO2 | 10.1021/jm300682j | ||
44404954 | 134742 | 0 | None | -48 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm058225d | ||
CHEMBL372588 | 134742 | 0 | None | -48 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm058225d | ||
44411814 | 77856 | 0 | None | -218 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 495 | 5 | 1 | 4 | 5.0 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2cccc(Cl)c2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210615 | 77856 | 0 | None | -218 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 495 | 5 | 1 | 4 | 5.0 | CS(=O)(=O)c1cc(Br)c2c(c1)c1c(n2Cc2cccc(Cl)c2)C(CC(=O)O)CC1 | 10.1016/j.bmcl.2006.02.062 | ||
10455224 | 10368 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 427 | 9 | 2 | 4 | 4.2 | O=C(O)c1cccc(C(SCCNS(=O)(=O)c2ccccc2)c2ccccc2)c1 | 10.1021/jm00096a016 | ||
CHEMBL116465 | 10368 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 427 | 9 | 2 | 4 | 4.2 | O=C(O)c1cccc(C(SCCNS(=O)(=O)c2ccccc2)c2ccccc2)c1 | 10.1021/jm00096a016 | ||
10455224 | 10368 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 427 | 9 | 2 | 4 | 4.2 | O=C(O)c1cccc(C(SCCNS(=O)(=O)c2ccccc2)c2ccccc2)c1 | 10.1021/jm00096a016 | ||
CHEMBL116465 | 10368 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 427 | 9 | 2 | 4 | 4.2 | O=C(O)c1cccc(C(SCCNS(=O)(=O)c2ccccc2)c2ccccc2)c1 | 10.1021/jm00096a016 | ||
11374965 | 68851 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 476 | 11 | 2 | 5 | 5.7 | CC(SCCc1c(CCO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
CHEMBL192662 | 68851 | 0 | None | 2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 476 | 11 | 2 | 5 | 5.7 | CC(SCCc1c(CCO)oc2c(OCC(=O)O)cccc12)(c1ccccc1)c1ccccc1 | 10.1021/jm050194z | ||
10432190 | 183514 | 0 | None | -6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 418 | 5 | 1 | 5 | 5.9 | CSc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL482548 | 183514 | 0 | None | -6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 418 | 5 | 1 | 5 | 5.9 | CSc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
46890179 | 6979 | 0 | None | -269 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 476 | 7 | 1 | 5 | 4.2 | Cc1c(C2c3ccccc3S(=O)(=O)N2CCOc2ccccc2)c2ccccc2n1CC(=O)O | 10.1016/j.bmcl.2010.04.046 | ||
CHEMBL1084903 | 6979 | 0 | None | -269 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 476 | 7 | 1 | 5 | 4.2 | Cc1c(C2c3ccccc3S(=O)(=O)N2CCOc2ccccc2)c2ccccc2n1CC(=O)O | 10.1016/j.bmcl.2010.04.046 | ||
10431100 | 167521 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 400 | 3 | 1 | 4 | 4.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(F)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL432602 | 167521 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 400 | 3 | 1 | 4 | 4.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3cc(F)ccc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
44271646 | 62662 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 358 | 4 | 1 | 3 | 4.5 | O=C(O)[C@H]1CC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
CHEMBL17861 | 62662 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 358 | 4 | 1 | 3 | 4.5 | O=C(O)[C@H]1CC[C@@H]1c1nc2cc(F)ccc2n1Cc1ccc(Cl)cc1 | 10.1021/jm00061a008 | ||
44411984 | 76967 | 0 | None | -107 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.7 | CC(C)(C)c1ccc(Cn2c3c(c4cc(S(C)(=O)=O)cc(Br)c42)CCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL208319 | 76967 | 0 | None | -107 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 517 | 5 | 1 | 4 | 5.7 | CC(C)(C)c1ccc(Cn2c3c(c4cc(S(C)(=O)=O)cc(Br)c42)CCC3CC(=O)O)cc1 | 10.1016/j.bmcl.2006.02.062 | ||
10834286 | 113962 | 0 | None | -19 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 391 | 2 | 3 | 3 | 4.6 | Oc1cc2c(cc1O)C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC2 | 10.1021/jm960208o | ||
CHEMBL333438 | 113962 | 0 | None | -19 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 391 | 2 | 3 | 3 | 4.6 | Oc1cc2c(cc1O)C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC2 | 10.1021/jm960208o | ||
14953075 | 97989 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 414 | 6 | 1 | 3 | 5.8 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CCCCC1 | 10.1021/jm00061a008 | ||
CHEMBL275651 | 97989 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 414 | 6 | 1 | 3 | 5.8 | O=C(O)CC1(Cc2nc3cc(F)ccc3n2Cc2ccc(Cl)cc2)CCCCC1 | 10.1021/jm00061a008 | ||
10456019 | 162939 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc(OC)c2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
CHEMBL420136 | 162939 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 442 | 5 | 1 | 6 | 4.8 | COc1cc(OC)c2ncn(C/C=C3\c4ccccc4COc4ccc(C(=O)O)cc43)c2c1 | 10.1021/jm00096a017 | ||
44411567 | 138314 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(C(=O)Nc3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL378151 | 138314 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 472 | 6 | 2 | 3 | 6.5 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c(C(=O)Nc3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
11282319 | 67322 | 0 | None | 8 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 448 | 10 | 2 | 5 | 5.5 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)c3ccccc3)c(CO)oc12 | 10.1021/jm050194z | ||
CHEMBL190708 | 67322 | 0 | None | 8 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 448 | 10 | 2 | 5 | 5.5 | O=C(O)COc1cccc2c(CCSC(c3ccccc3)c3ccccc3)c(CO)oc12 | 10.1021/jm050194z | ||
53323246 | 56514 | 0 | None | -81 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3c(F)cccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643770 | 56514 | 0 | None | -81 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3c(F)cccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
15157541 | 96690 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 395 | 5 | 1 | 2 | 6.4 | CC(C)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL267820 | 96690 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 395 | 5 | 1 | 2 | 6.4 | CC(C)c1cccc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CCC3 | 10.1016/j.bmcl.2006.02.062 | ||
10365194 | 10328 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc([N+](=O)[O-])cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL116342 | 10328 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.7 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc([N+](=O)[O-])cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
10001037 | 9959 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 400 | 3 | 1 | 4 | 4.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(F)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
CHEMBL115238 | 9959 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 400 | 3 | 1 | 4 | 4.9 | O=C(O)c1ccc2c(c1)/C(=C/Cn1cnc3ccc(F)cc31)c1ccccc1CO2 | 10.1021/jm00096a017 | ||
44338308 | 9062 | 0 | None | 3 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 391 | 5 | 1 | 5 | 5.3 | COC(=O)c1ccc(Nc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL110063 | 9062 | 0 | None | 3 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 391 | 5 | 1 | 5 | 5.3 | COC(=O)c1ccc(Nc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
53320617 | 56532 | 0 | None | -575 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 472 | 9 | 1 | 4 | 4.6 | CCCCCN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643787 | 56532 | 0 | None | -575 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 472 | 9 | 1 | 4 | 4.6 | CCCCCN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
44338387 | 109949 | 1 | None | -61 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 422 | 6 | 0 | 5 | 5.8 | COC(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL324619 | 109949 | 1 | None | -61 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 422 | 6 | 0 | 5 | 5.8 | COC(=O)c1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
10029290 | 9790 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1cc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc(OC)c1OC | 10.1021/jm00096a016 | ||
CHEMBL114260 | 9790 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1cc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc(OC)c1OC | 10.1021/jm00096a016 | ||
10029290 | 9790 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1cc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc(OC)c1OC | 10.1021/jm00096a016 | ||
CHEMBL114260 | 9790 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 509 | 9 | 2 | 7 | 4.6 | COc1cc(C(=O)NCCSC2c3ccccc3COc3ccc(C(=O)O)cc32)cc(OC)c1OC | 10.1021/jm00096a016 | ||
11519006 | 102013 | 0 | None | -151 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 481 | 8 | 1 | 5 | 6.1 | O=C(O)COc1cccc(C[C@@H]2CCC[C@H]3O[C@]23c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 | 10.1016/j.bmcl.2005.04.076 | ||
CHEMBL2373410 | 102013 | 0 | None | -151 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 481 | 8 | 1 | 5 | 6.1 | O=C(O)COc1cccc(C[C@@H]2CCC[C@H]3O[C@]23c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 | 10.1016/j.bmcl.2005.04.076 | ||
CHEMBL3040272 | 102013 | 0 | None | -151 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 481 | 8 | 1 | 5 | 6.1 | O=C(O)COc1cccc(C[C@@H]2CCC[C@H]3O[C@]23c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 | 10.1016/j.bmcl.2005.04.076 | ||
44338389 | 5880 | 0 | None | -8 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 422 | 6 | 0 | 5 | 5.8 | COC(=O)c1cccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL107988 | 5880 | 0 | None | -8 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 422 | 6 | 0 | 5 | 5.8 | COC(=O)c1cccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2004.04.005 | ||
44138108 | 183703 | 0 | None | -2884 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL483991 | 183703 | 0 | None | -2884 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
44338257 | 9219 | 0 | None | 4 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 5 | 0 | 4 | 5.9 | N#Cc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
CHEMBL111006 | 9219 | 0 | None | 4 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 5 | 0 | 4 | 5.9 | N#Cc1ccc(CSc2nc3ccccc3n2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2004.04.005 | ||
10590325 | 129154 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 300 | 3 | 3 | 5 | 2.4 | O=[N+]([O-])c1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
CHEMBL367394 | 129154 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 300 | 3 | 3 | 5 | 2.4 | O=[N+]([O-])c1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 | 10.1021/jm950896w | ||
44411813 | 138716 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c([S+]([O-])c3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL378929 | 138716 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 477 | 6 | 1 | 3 | 6.4 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1c([S+]([O-])c3ccccc3)cccc21 | 10.1016/j.bmcl.2006.02.062 | ||
53319320 | 56525 | 0 | None | -954 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(F)c(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
CHEMBL1643780 | 56525 | 0 | None | -954 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 452 | 5 | 1 | 4 | 3.3 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(F)c(F)c3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | ||
14372503 | 77898 | 0 | None | -12 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 4.6 | CS(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CCC1 | 10.1016/j.bmcl.2006.02.062 | ||
CHEMBL210807 | 77898 | 0 | None | -12 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 4.6 | CS(=O)(=O)c1ccc2c(c1)c1c(n2Cc2ccc(Cl)cc2)C(CC(=O)O)CCC1 | 10.1016/j.bmcl.2006.02.062 | ||
44591514 | 191183 | 0 | None | -398 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 446 | 5 | 1 | 4 | 6.7 | O=C(O)CC1CCCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(C3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL519803 | 191183 | 0 | None | -398 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 446 | 5 | 1 | 4 | 6.7 | O=C(O)CC1CCCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(C3CC3)nccc12 | 10.1016/j.bmcl.2009.03.010 | ||
10028338 | 179240 | 0 | None | -776 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
CHEMBL474502 | 179240 | 0 | None | -776 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 484 | 5 | 1 | 6 | 5.3 | CS(=O)(=O)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | ||
65772 | 216007 | 0 | None | - | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 345 | 5 | 3 | 6 | 2.6 | COC1=CC(C[C@@H]2NCCC3=CC(O)=C(O)C=C23)=CC(OC)=C1OC | None | ||
2449 | 202529 | 90 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 354 | 8 | 1 | 3 | 4.6 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccccc2)=C(C)C1=O | None | ||
CHEMBL70972 | 202529 | 90 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 354 | 8 | 1 | 3 | 4.6 | CC1=C(C)C(=O)C(C(CCCCCC(=O)O)c2ccccc2)=C(C)C1=O | None | ||
6069 | 1 | 0 | None | -8 | 8 | Human | 7.0 | pKd | = | 7 | Binding | Guide to Pharmacology | 386 | 12 | 2 | 3 | 4.7 | CCCCC[C@@H](/C=C/[C@H]1C[C@@H]2O[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2(F)F)O | 2748606 | ||
73755171 | 1 | 0 | None | -8 | 8 | Human | 7.0 | pKd | = | 7 | Binding | Guide to Pharmacology | 386 | 12 | 2 | 3 | 4.7 | CCCCC[C@@H](/C=C/[C@H]1C[C@@H]2O[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2(F)F)O | 2748606 | ||
1980 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
1980 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
1985 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
1985 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
6437074 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
6437074 | 3605 | 0 | None | -8 | 9 | Human | 7.8 | pKd | = | 7.8 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
1938 | 1938 | 14 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 1830308 | ||
5311175 | 1938 | 14 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 1830308 | ||
CHEMBL2113346 | 1938 | 14 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 1830308 | ||
22524604 | 2047 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | 531 | 9 | 2 | 3 | 4.8 | OC(=O)CCC/C=C\C[C@@H]1[C@H](C[C@@H]2C[C@H]1C2(C)C)NS(=O)(=O)c1ccc(cc1)I | 1386885 | ||
3332 | 2047 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | 531 | 9 | 2 | 3 | 4.8 | OC(=O)CCC/C=C\C[C@@H]1[C@H](C[C@@H]2C[C@H]1C2(C)C)NS(=O)(=O)c1ccc(cc1)I | 1386885 | ||
1888 | 3837 | 26 | None | 2 | 17 | Human | 7.8 | pKd | None | 7.8 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
1974 | 3837 | 26 | None | 2 | 17 | Human | 7.8 | pKd | None | 7.8 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
5311493 | 3837 | 26 | None | 2 | 17 | Human | 7.8 | pKd | None | 7.8 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
CHEMBL521784 | 3837 | 26 | None | 2 | 17 | Human | 7.8 | pKd | None | 7.8 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
134694160 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
1979 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
1984 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
3165 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
5312138 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
CHEMBL3301671 | 1433 | 0 | None | -1 | 2 | Mouse | 8.5 | pKd | None | 8.5 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1375456 | ||
134694160 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
1979 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
1984 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
3165 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
5312138 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
CHEMBL3301671 | 1433 | 0 | None | 1 | 2 | Human | 8.9 | pKd | None | 8.9 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1825698 | ||
1980 | 3605 | 0 | None | 8 | 9 | Rat | 9.0 | pKd | None | 9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 7635958 | ||
1985 | 3605 | 0 | None | 8 | 9 | Rat | 9.0 | pKd | None | 9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 7635958 | ||
6437074 | 3605 | 0 | None | 8 | 9 | Rat | 9.0 | pKd | None | 9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 7635958 | ||
135398737 | 944 | 89 | 3H-SQ 29548 | -416 | 91 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | ||
38 | 944 | 89 | 3H-SQ 29548 | -416 | 91 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | ||
722 | 944 | 89 | 3H-SQ 29548 | -416 | 91 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | ||
CHEMBL42 | 944 | 89 | 3H-SQ 29548 | -416 | 91 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | ||
DB00363 | 944 | 89 | 3H-SQ 29548 | -416 | 91 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | ||
1222 | 1634 | 44 | 3H-SQ 29548 | -1659 | 32 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | ||
3396 | 1634 | 44 | 3H-SQ 29548 | -1659 | 32 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | ||
85 | 1634 | 44 | 3H-SQ 29548 | -1659 | 32 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | ||
CHEMBL46516 | 1634 | 44 | 3H-SQ 29548 | -1659 | 32 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | ||
DB04842 | 1634 | 44 | 3H-SQ 29548 | -1659 | 32 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | ||
1353 | 1880 | 85 | 3H-SQ 29548 | -691 | 85 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | ||
3559 | 1880 | 85 | 3H-SQ 29548 | -691 | 85 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | ||
86 | 1880 | 85 | 3H-SQ 29548 | -691 | 85 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | ||
CHEMBL54 | 1880 | 85 | 3H-SQ 29548 | -691 | 85 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | ||
DB00502 | 1880 | 85 | 3H-SQ 29548 | -691 | 85 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | ||
135398745 | 2869 | 108 | 3H-SQ 29548 | -512 | 65 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | ||
47 | 2869 | 108 | 3H-SQ 29548 | -512 | 65 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | ||
CHEMBL715 | 2869 | 108 | 3H-SQ 29548 | -512 | 65 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | ||
DB00334 | 2869 | 108 | 3H-SQ 29548 | -512 | 65 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | ||
2181 | 3079 | 0 | 3H-SQ 29548 | -158 | 34 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | ||
4830 | 3079 | 0 | 3H-SQ 29548 | -158 | 34 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | ||
92 | 3079 | 0 | 3H-SQ 29548 | -158 | 34 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | ||
CHEMBL440294 | 3079 | 0 | 3H-SQ 29548 | -158 | 34 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | ||
DB09286 | 3079 | 0 | 3H-SQ 29548 | -158 | 34 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | ||
2337 | 3205 | 72 | 3H-SQ 29548 | -112 | 62 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
50 | 3205 | 72 | 3H-SQ 29548 | -112 | 62 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
5002 | 3205 | 72 | 3H-SQ 29548 | -112 | 62 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
CHEMBL716 | 3205 | 72 | 3H-SQ 29548 | -112 | 62 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
DB01224 | 3205 | 72 | 3H-SQ 29548 | -112 | 62 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
2389 | 3279 | 114 | 3H-SQ 29548 | -2570 | 67 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | ||
5073 | 3279 | 114 | 3H-SQ 29548 | -2570 | 67 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | ||
96 | 3279 | 114 | 3H-SQ 29548 | -2570 | 67 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | ||
CHEMBL85 | 3279 | 114 | 3H-SQ 29548 | -2570 | 67 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | ||
DB00734 | 3279 | 114 | 3H-SQ 29548 | -2570 | 67 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | ||
2435 | 3533 | 78 | 3H-SQ 29548 | -1949 | 48 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | ||
60149 | 3533 | 78 | 3H-SQ 29548 | -1949 | 48 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | ||
98 | 3533 | 78 | 3H-SQ 29548 | -1949 | 48 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | ||
CHEMBL12713 | 3533 | 78 | 3H-SQ 29548 | -1949 | 48 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | ||
DB06144 | 3533 | 78 | 3H-SQ 29548 | -1949 | 48 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | ||
2865 | 4079 | 67 | 3H-SQ 29548 | -2041 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | ||
59 | 4079 | 67 | 3H-SQ 29548 | -2041 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | ||
60854 | 4079 | 67 | 3H-SQ 29548 | -2041 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | ||
CHEMBL708 | 4079 | 67 | 3H-SQ 29548 | -2041 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | ||
DB00246 | 4079 | 67 | 3H-SQ 29548 | -2041 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | ||
103 | 4089 | 56 | 3H-SQ 29548 | -831 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | ||
2875 | 4089 | 56 | 3H-SQ 29548 | -831 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | ||
5736 | 4089 | 56 | 3H-SQ 29548 | -831 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | ||
CHEMBL285802 | 4089 | 56 | 3H-SQ 29548 | -831 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | ||
DB09225 | 4089 | 56 | 3H-SQ 29548 | -831 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | ||
115237 | 55296 | 113 | 3H-SQ 29548 | -776 | 54 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | ||
CHEMBL1621 | 55296 | 113 | 3H-SQ 29548 | -776 | 54 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | ||
46780481 | 107045 | 18 | 3H-SQ 29548 | -5888 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | ||
9903970 | 107045 | 18 | 3H-SQ 29548 | -5888 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | ||
CHEMBL3187365 | 107045 | 18 | 3H-SQ 29548 | -5888 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | ||
CHEMBL3544974 | 107045 | 18 | 3H-SQ 29548 | -5888 | 53 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | ||
1881 | 3030 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | -4570 | 21 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
1891 | 3030 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | -4570 | 21 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
448457 | 3030 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | -4570 | 21 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
CHEMBL1235252 | 3030 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | -4570 | 21 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
DB02056 | 3030 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | -4570 | 21 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
138 | 3032 | 84 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 18 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
1882 | 3032 | 84 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 18 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
5280723 | 3032 | 84 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 18 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
CHEMBL495 | 3032 | 84 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 18 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
DB00770 | 3032 | 84 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 18 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | ||
1883 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
1916 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
5280360 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
913 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
CHEMBL548 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
DB00917 | 3033 | 71 | 3H-15(S)9,11-epoxymethano PGH2 | -10000 | 24 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
1884 | 3034 | 46 | 3H-15(S)9,11-epoxymethano PGH2 | -3019 | 22 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
5280363 | 3034 | 46 | 3H-15(S)9,11-epoxymethano PGH2 | -3019 | 22 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
912 | 3034 | 46 | 3H-15(S)9,11-epoxymethano PGH2 | -3019 | 22 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
CHEMBL815 | 3034 | 46 | 3H-15(S)9,11-epoxymethano PGH2 | -3019 | 22 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
DB12789 | 3034 | 46 | 3H-15(S)9,11-epoxymethano PGH2 | -3019 | 22 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
243 | 3153 | 85 | 3H-SQ 29548 | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | ||
3052762 | 3153 | 85 | 3H-SQ 29548 | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | ||
3502 | 3153 | 85 | 3H-SQ 29548 | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | ||
CHEMBL117287 | 3153 | 85 | 3H-SQ 29548 | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | ||
DB06480 | 3153 | 85 | 3H-SQ 29548 | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | ||
44208932 | 140176 | 6 | UNDEFINED | -120226 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | ||
CHEMBL381689 | 140176 | 6 | UNDEFINED | -120226 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | ||
None | 214690 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 12 | 4 | 4 | 3.4 | CCCCCC(C)(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)O | None | ||
None | 214692 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 304 | 14 | 1 | 1 | 6.2 | CCCCCC=CCC=CCC=CCC=CCCCC(=O)O | None | ||
None | 214752 | 0 | 3H-SQ 29548 | -10471285 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 372 | 2 | 1 | 3 | 4.4 | CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)Cl | None | ||
None | 214687 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 348 | 12 | 2 | 4 | 4.5 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)N=N2)O | None | ||
None | 214355 | 0 | 125I-BOP | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 541 | 11 | 4 | 4 | 4.7 | CC1(C2CC1C(C(C2)NCC(CC3=CC(=C(C=C3)O)I)O)CC=CCCCC(=O)O)C | None | ||
None | 214355 | 0 | 125I-BOP | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 541 | 11 | 4 | 4 | 4.7 | CC1(C2CC1C(C(C2)NCC(CC3=CC(=C(C=C3)O)I)O)CC=CCCCC(=O)O)C | None | ||
None | 214691 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 388 | 12 | 2 | 4 | 4.1 | CCCCCC(C=CC1C(C2C(C(O1)O2)(F)F)CC=CCCCC(=O)O)O | None | ||
1980 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1980 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
None | 214466 | 0 | 125I-BOP | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 373 | 4 | 1 | 2 | 5.2 | C1CC(C2C(C1)C3=C(N2CC4=CC=C(C=C4)Cl)C=CC(=C3)F)CC(=O)O | None | ||
1980 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
None | 214686 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 352 | 12 | 2 | 4 | 4.0 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OO2)O | None | ||
1888 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
None | 214686 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 352 | 12 | 2 | 4 | 4.0 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OO2)O | None | ||
None | 214473 | 0 | 3H-SQ 29548 | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 422 | 15 | 3 | 4 | 3.2 | CCCCCCC(=O)NCC(=O)NCC1C2CCC(C1CC=CCCCC(=O)O)O2 | None | ||
1888 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 3H-SQ 29548 | 2 | 17 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
None | 214472 | 0 | 3H-SQ 29548 | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 384 | 10 | 2 | 3 | 4.7 | CC(C1=CC=CC=C1)C(C=CC2C3CCC(C2CC=CCCCC(=O)O)O3)O | None | ||
None | 214688 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 408 | 11 | 4 | 5 | 2.7 | C1C(C(C(C1O)C=CC(COC2=CC=C(C=C2)F)O)CC=CCCCC(=O)O)O | None | ||
None | 214354 | 0 | 125I-BOP | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OC2)O | None | ||
None | 214354 | 0 | 3H-SQ 29548 | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OC2)O | None | ||
1883 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
1916 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
5280360 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
913 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
CHEMBL548 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
DB00917 | 3033 | 71 | None | -380 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | ||
1980 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 125I-BOP | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
None | 214355 | 0 | 125I-BOP | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 541 | 11 | 4 | 4 | 4.7 | CC1(C2CC1C(C(C2)NCC(CC3=CC(=C(C=C3)O)I)O)CC=CCCCC(=O)O)C | None | ||
None | 214354 | 0 | 125I-BOP | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OC2)O | None | ||
None | 214693 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 383 | 9 | 3 | 3 | 4.7 | C1CC2CC1C(C2C=NNC(=O)NC3=CC=CC=C3)CC=CCCCC(=O)O | None | ||
None | 214473 | 0 | 3H-SQ 29548 | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 422 | 15 | 3 | 4 | 3.2 | CCCCCCC(=O)NCC(=O)NCC1C2CCC(C1CC=CCCCC(=O)O)O2 | None | ||
1884 | 3034 | 46 | None | -61 | 22 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
5280363 | 3034 | 46 | None | -61 | 22 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
912 | 3034 | 46 | None | -61 | 22 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
CHEMBL815 | 3034 | 46 | None | -61 | 22 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
DB12789 | 3034 | 46 | None | -61 | 22 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
138107701 | 186881 | 39 | None | -5 | 15 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
5311181 | 186881 | 39 | None | -5 | 15 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
CHEMBL494 | 186881 | 39 | None | -5 | 15 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | ||
1980 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1888 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1888 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
None | 214354 | 0 | 125I-BOP | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OC2)O | None | ||
None | 214354 | 0 | 3H-SQ 29548 | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)OC2)O | None | ||
1980 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
1985 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
6437074 | 3605 | 0 | 3H-SQ 29548 | -8 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | ||
None | 214374 | 0 | 3H-SQ 29548 | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 477 | 11 | 2 | 4 | 5.7 | C1CCN(CC1)C2C(CC(C2CCC=CCCC(=O)O)OCC3=CC=C(C=C3)C4=CC=CC=C4)O | None | ||
None | 214472 | 0 | 3H-SQ 29548 | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 384 | 10 | 2 | 3 | 4.7 | CC(C1=CC=CC=C1)C(C=CC2C3CCC(C2CC=CCCCC(=O)O)O3)O | None | ||
1888 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
None | 214689 | 0 | 3H-15(S)9,11-epoxymethano PGH2 | - | 1 | Mouse | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)C(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)O | None | ||
3356 | 2248 | 68 | None | -38 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
4326 | 2248 | 68 | None | -38 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
9867642 | 2248 | 68 | None | -38 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
CHEMBL426559 | 2248 | 68 | None | -38 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
DB11629 | 2248 | 68 | None | -38 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | ||
1888 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
1974 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
5311493 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
CHEMBL521784 | 3837 | 26 | 125I-BOP | 2 | 17 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | ||
134694160 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
1979 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
1984 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
3165 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
5312138 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
CHEMBL3301671 | 1433 | 0 | None | -1 | 2 | Mouse | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
123879 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
1910 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
1911 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
2354 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
CHEMBL361812 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
DB13036 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | ||
134694160 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
1979 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
1984 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
3165 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
5312138 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
CHEMBL3301671 | 1433 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | None | ||
3356 | 2248 | 68 | None | -38 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 17882161 | ||
4326 | 2248 | 68 | None | -38 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 17882161 | ||
9867642 | 2248 | 68 | None | -38 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 17882161 | ||
CHEMBL426559 | 2248 | 68 | None | -38 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 17882161 | ||
DB11629 | 2248 | 68 | None | -38 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | Guide to Pharmacology | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 17882161 | ||
1888 | 3837 | 26 | None | 2 | 17 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
1974 | 3837 | 26 | None | 2 | 17 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
5311493 | 3837 | 26 | None | 2 | 17 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
CHEMBL521784 | 3837 | 26 | None | 2 | 17 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | ||
123879 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
1910 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
1911 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
2354 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
CHEMBL361812 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
DB13036 | 3235 | 77 | None | 3 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | 1387312 | ||
1978 | 2888 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 391 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@@H]1[C@@H](NC(=O)[C@@H](C2CCCC2)O)C[C@H]2C[C@@H]1C2(C)C | 3008368 | ||
5311334 | 2888 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 391 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@@H]1[C@@H](NC(=O)[C@@H](C2CCCC2)O)C[C@H]2C[C@@H]1C2(C)C | 3008368 | ||
CHEMBL266243 | 2888 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 391 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@@H]1[C@@H](NC(=O)[C@@H](C2CCCC2)O)C[C@H]2C[C@@H]1C2(C)C | 3008368 | ||
1987 | 1958 | 16 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 8437108 | ||
3037233 | 1958 | 16 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 8437108 | ||
CHEMBL3301673 | 1958 | 16 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 8437108 | ||
DB12321 | 1958 | 16 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 440 | 11 | 2 | 5 | 4.1 | CCCCCNC(=O)c1coc(n1)[C@@H]1[C@H]2CC[C@@H]([C@@H]1Cc1ccccc1CCC(=O)O)O2 | 8437108 | ||
1980 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
1980 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
1980 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 2975605 | ||
1985 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
1985 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
1985 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 2975605 | ||
6437074 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 10634944 | ||
6437074 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 16604093 | ||
6437074 | 3605 | 0 | None | -8 | 9 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 2975605 | ||
1976 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 2527074 | ||
1976 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 8242228 | ||
6918030 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 2527074 | ||
6918030 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 8242228 | ||
CHEMBL65030 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 2527074 | ||
CHEMBL65030 | 3910 | 12 | None | 8 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 8242228 | ||
1940 | 1633 | 38 | None | -20892 | 10 | Human | 4.3 | pKi | None | 4.3 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
3417 | 1633 | 38 | None | -20892 | 10 | Human | 4.3 | pKi | None | 4.3 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
5311100 | 1633 | 38 | None | -20892 | 10 | Human | 4.3 | pKi | None | 4.3 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
CHEMBL1201379 | 1633 | 38 | None | -20892 | 10 | Human | 4.3 | pKi | None | 4.3 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
DB11519 | 1633 | 38 | None | -20892 | 10 | Human | 4.3 | pKi | None | 4.3 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | ||
1883 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
1916 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
5280360 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
913 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
CHEMBL548 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
DB00917 | 3033 | 71 | None | -380 | 24 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | ||
1892 | 736 | 15 | None | -316 | 9 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 394 | 13 | 3 | 4 | 4.3 | CCCC1(CCC1)[C@H](C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | 10634944 | ||
25886893 | 736 | 15 | None | -316 | 9 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 394 | 13 | 3 | 4 | 4.3 | CCCC1(CCC1)[C@H](C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | 10634944 | ||
CHEMBL1628262 | 736 | 15 | None | -316 | 9 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 394 | 13 | 3 | 4 | 4.3 | CCCC1(CCC1)[C@H](C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | 10634944 | ||
1893 | 783 | 0 | None | -1412 | 13 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
5311242 | 783 | 0 | None | -1412 | 13 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
CHEMBL148319 | 783 | 0 | None | -1412 | 13 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | ||
1884 | 3034 | 46 | None | -61 | 22 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
5280363 | 3034 | 46 | None | -61 | 22 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
912 | 3034 | 46 | None | -61 | 22 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
CHEMBL815 | 3034 | 46 | None | -61 | 22 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
DB12789 | 3034 | 46 | None | -61 | 22 | Human | 5.1 | pKi | None | 5.1 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | ||
1894 | 943 | 35 | None | -1621 | 5 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
5311053 | 943 | 35 | None | -1621 | 5 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
CHEMBL37853 | 943 | 35 | None | -1621 | 5 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
DB11507 | 943 | 35 | None | -1621 | 5 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | ||
1895 | 1976 | 0 | None | -630 | 16 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
6435378 | 1976 | 0 | None | -630 | 16 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
CHEMBL236025 | 1976 | 0 | None | -630 | 16 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
DB01088 | 1976 | 0 | None | -630 | 16 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | ||
1949 | 315 | 0 | None | 12 | 3 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 477 | 11 | 1 | 5 | 4.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)CC(=O)[C@@H]1N1CCOCC1 | 10634944 | ||
5310999 | 315 | 0 | None | 12 | 3 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 477 | 11 | 1 | 5 | 4.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)CC(=O)[C@@H]1N1CCOCC1 | 10634944 | ||
1970 | 786 | 0 | None | - | 1 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 348 | 12 | 2 | 2 | 5.3 | CCCCC[C@@H](/C=C/[C@H]1CC2CC([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
5311387 | 786 | 0 | None | - | 1 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 348 | 12 | 2 | 2 | 5.3 | CCCCC[C@@H](/C=C/[C@H]1CC2CC([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
1913 | 2429 | 0 | None | -2238 | 15 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | ||
5311223 | 2429 | 0 | None | -2238 | 15 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | ||
1920 | 2892 | 0 | None | -125 | 4 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 439 | 9 | 2 | 3 | 4.8 | OC(=O)CCC/C=C\[C@H]1C2CCC([C@@H]1CNS(=O)(=O)c1ccc(cc1C)Cl)CC2 | 10537280 | ||
9824507 | 2892 | 0 | None | -125 | 4 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 439 | 9 | 2 | 3 | 4.8 | OC(=O)CCC/C=C\[C@H]1C2CCC([C@@H]1CNS(=O)(=O)c1ccc(cc1C)Cl)CC2 | 10537280 | ||
CHEMBL1628612 | 2892 | 0 | None | -125 | 4 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 439 | 9 | 2 | 3 | 4.8 | OC(=O)CCC/C=C\[C@H]1C2CCC([C@@H]1CNS(=O)(=O)c1ccc(cc1C)Cl)CC2 | 10537280 | ||
1888 | 3837 | 26 | None | -2 | 17 | Mouse | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
1974 | 3837 | 26 | None | -2 | 17 | Mouse | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
5311493 | 3837 | 26 | None | -2 | 17 | Mouse | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
CHEMBL521784 | 3837 | 26 | None | -2 | 17 | Mouse | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | ||
1898 | 3394 | 0 | None | -15 | 2 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 441 | 8 | 3 | 4 | 5.6 | OC(=O)CCC/C=C\C[C@@H]1C[C@H]2C[C@@H]([C@@H]1NC(=O)c1csc3c1cc(O)cc3)C2(C)C | 11454901 | ||
5311213 | 3394 | 0 | None | -15 | 2 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 441 | 8 | 3 | 4 | 5.6 | OC(=O)CCC/C=C\C[C@@H]1C[C@H]2C[C@@H]([C@@H]1NC(=O)c1csc3c1cc(O)cc3)C2(C)C | 11454901 | ||
1986 | 1285 | 46 | None | - | 1 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 1434130 | ||
54343 | 1285 | 46 | None | - | 1 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 1434130 | ||
CHEMBL71685 | 1285 | 46 | None | - | 1 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 353 | 7 | 2 | 3 | 2.5 | OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl | 1434130 | ||
1980 | 3605 | 0 | None | -12 | 9 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 9313928 | ||
1985 | 3605 | 0 | None | -12 | 9 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 9313928 | ||
6437074 | 3605 | 0 | None | -12 | 9 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | 9313928 | ||
1939 | 3632 | 0 | None | 1 | 2 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 366 | 12 | 2 | 3 | 5.2 | CCCCC[C@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)S2)O | 9313928 | ||
5311453 | 3632 | 0 | None | 1 | 2 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 366 | 12 | 2 | 3 | 5.2 | CCCCC[C@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)S2)O | 9313928 | ||
1976 | 3910 | 12 | None | -8 | 2 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 9313928 | ||
6918030 | 3910 | 12 | None | -8 | 2 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 9313928 | ||
CHEMBL65030 | 3910 | 12 | None | -8 | 2 | Mouse | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 477 | 11 | 2 | 4 | 5.7 | OC(=O)CC/C=C\CC[C@H]1[C@@H](OCc2ccc(cc2)c2ccccc2)C[C@@H]([C@@H]1N1CCCCC1)O | 9313928 | ||
1972 | 3035 | 0 | None | - | 1 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 352 | 12 | 2 | 4 | 4.0 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OO[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
445049 | 3035 | 0 | None | - | 1 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 352 | 12 | 2 | 4 | 4.0 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OO[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
4483 | 3035 | 0 | None | - | 1 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 352 | 12 | 2 | 4 | 4.0 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OO[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
CHEMBL2074582 | 3035 | 0 | None | - | 1 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 352 | 12 | 2 | 4 | 4.0 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OO[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 1434130 | ||
1971 | 1539 | 0 | None | - | 1 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 404 | 11 | 2 | 4 | 4.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@@H](COc1ccc(cc1)F)O)O2 | 2743082 | ||
5311384 | 1539 | 0 | None | - | 1 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 404 | 11 | 2 | 4 | 4.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@@H](COc1ccc(cc1)F)O)O2 | 2743082 | ||
19088577 | 2173 | 0 | None | - | 1 | Human | 8.9 | pKi | None | 8.9 | Binding | Guide to Pharmacology | 409 | 3 | 0 | 5 | 4.0 | [O-]C(=O)c1ccc2c(c1)/C(=C/Cn1cnc3c1cc(C)c(c3)C)/c1ccccc1CO2 | 1434130 | ||
1977 | 2173 | 0 | None | - | 1 | Human | 8.9 | pKi | None | 8.9 | Binding | Guide to Pharmacology | 409 | 3 | 0 | 5 | 4.0 | [O-]C(=O)c1ccc2c(c1)/C(=C/Cn1cnc3c1cc(C)c(c3)C)/c1ccccc1CO2 | 1434130 | ||
134694160 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
1979 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
1984 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
3165 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
5312138 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
CHEMBL3301671 | 1433 | 0 | None | -1 | 2 | Mouse | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 9313928 | ||
1938 | 1938 | 14 | None | 1 | 4 | Mouse | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
5311175 | 1938 | 14 | None | 1 | 4 | Mouse | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
CHEMBL2113346 | 1938 | 14 | None | 1 | 4 | Mouse | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | ||
134694160 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 | ||
1979 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 | ||
1984 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 | ||
3165 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 | ||
5312138 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 | ||
CHEMBL3301671 | 1433 | 0 | None | 1 | 2 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | 377 | 9 | 2 | 3 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1NS(=O)(=O)c1ccccc1)C2 | 1833018 |