Ligand source activities (1 row/activity)
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
2720 | 10626 | 59 | None | 5 | 5 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 10.1016/j.ejmech.2022.114154 | ||
5820 | 10626 | 59 | None | 5 | 5 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 10.1016/j.ejmech.2022.114154 | ||
6918140 | 10626 | 59 | None | 5 | 5 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 10.1016/j.ejmech.2022.114154 | ||
CHEMBL1237119 | 10626 | 59 | None | 5 | 5 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 10.1016/j.ejmech.2022.114154 | ||
DB00374 | 10626 | 59 | None | 5 | 5 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 10.1016/j.ejmech.2022.114154 | ||
5077 | 10351 | 79 | None | 5 | 13 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
7552 | 10351 | 79 | None | 5 | 13 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
9913767 | 10351 | 79 | None | 5 | 13 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL238804 | 10351 | 79 | None | 5 | 13 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
DB11362 | 10351 | 79 | None | 5 | 13 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
44236221 | 154497 | 0 | None | -97 | 3 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 445 | 9 | 1 | 5 | 5.0 | COc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2cccc(F)c2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3932106 | 154497 | 0 | None | -97 | 3 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 445 | 9 | 1 | 5 | 5.0 | COc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2cccc(F)c2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
11855865 | 160056 | 0 | None | -478 | 3 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 445 | 12 | 2 | 5 | 5.2 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3977724 | 160056 | 0 | None | -478 | 3 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 445 | 12 | 2 | 5 | 5.2 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
44232564 | 152207 | 0 | None | -162 | 3 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 449 | 8 | 1 | 4 | 5.7 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(Cl)cc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3914174 | 152207 | 0 | None | -162 | 3 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 449 | 8 | 1 | 4 | 5.7 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(Cl)cc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
118727315 | 124208 | 0 | None | -4 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CC[C@@H](Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | ||
CHEMBL3398236 | 124208 | 0 | None | -4 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CC[C@@H](Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | ||
138107701 | 194243 | 46 | None | -354 | 7 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 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 | 10.1021/acs.jmedchem.6b00871 | ||
5311181 | 194243 | 46 | None | -354 | 7 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 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 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL494 | 194243 | 46 | None | -354 | 7 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 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 | 10.1021/acs.jmedchem.6b00871 | ||
5852 | 9395 | 55 | None | -1 | 6 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 419 | 11 | 1 | 5 | 4.9 | OC(=O)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
9931891 | 9395 | 55 | None | -1 | 6 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 419 | 11 | 1 | 5 | 4.9 | OC(=O)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL239226 | 9395 | 55 | None | -1 | 6 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 419 | 11 | 1 | 5 | 4.9 | OC(=O)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | 10.1021/acs.jmedchem.6b00871 | ||
56839342 | 155786 | 0 | None | -1 | 7 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
CHEMBL3942394 | 155786 | 0 | None | -1 | 7 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
44234532 | 150447 | 0 | None | -85 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 397 | 8 | 1 | 4 | 4.9 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3900038 | 150447 | 0 | None | -85 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 397 | 8 | 1 | 4 | 4.9 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
44234782 | 154050 | 0 | None | -190 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 427 | 9 | 1 | 5 | 4.9 | COc1cccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)c1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3928729 | 154050 | 0 | None | -190 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 427 | 9 | 1 | 5 | 4.9 | COc1cccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)c1 | 10.1021/acs.jmedchem.6b00871 | ||
56839536 | 149947 | 0 | None | 1 | 7 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
CHEMBL3896035 | 149947 | 0 | None | 1 | 7 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
11855324 | 149383 | 0 | None | -14 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 371 | 6 | 1 | 4 | 4.0 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)o2)cc1 | nan | ||
CHEMBL3891401 | 149383 | 0 | None | -14 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 371 | 6 | 1 | 4 | 4.0 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)o2)cc1 | nan | ||
11855324 | 149383 | 0 | None | -14 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 371 | 6 | 1 | 4 | 4.0 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)o2)cc1 | nan | ||
CHEMBL3891401 | 149383 | 0 | None | -14 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 371 | 6 | 1 | 4 | 4.0 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)o2)cc1 | nan | ||
44235521 | 153734 | 0 | None | -346 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 449 | 8 | 1 | 4 | 5.7 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)c(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3926078 | 153734 | 0 | None | -346 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 449 | 8 | 1 | 4 | 5.7 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)c(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
138107701 | 194243 | 46 | None | -354 | 7 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 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 | 10.1016/j.ejmech.2022.114154 | ||
5311181 | 194243 | 46 | None | -354 | 7 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 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 | 10.1016/j.ejmech.2022.114154 | ||
CHEMBL494 | 194243 | 46 | None | -354 | 7 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 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 | 10.1016/j.ejmech.2022.114154 | ||
11855325 | 151469 | 0 | None | -19 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 387 | 6 | 1 | 4 | 4.5 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3908484 | 151469 | 0 | None | -19 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 387 | 6 | 1 | 4 | 4.5 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
11855325 | 151469 | 0 | None | -19 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 387 | 6 | 1 | 4 | 4.5 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3908484 | 151469 | 0 | None | -19 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 387 | 6 | 1 | 4 | 4.5 | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
44235044 | 149641 | 0 | None | -41 | 3 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 427 | 9 | 1 | 5 | 4.9 | COc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3893346 | 149641 | 0 | None | -41 | 3 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 427 | 9 | 1 | 5 | 4.9 | COc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
44234032 | 154703 | 0 | None | -371 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3933704 | 154703 | 0 | None | -371 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
11855868 | 159323 | 0 | None | -602 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 429 | 11 | 2 | 4 | 5.6 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3971632 | 159323 | 0 | None | -602 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 429 | 11 | 2 | 4 | 5.6 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
11855868 | 159323 | 0 | None | -602 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 429 | 11 | 2 | 4 | 5.6 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3971632 | 159323 | 0 | None | -602 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 429 | 11 | 2 | 4 | 5.6 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
56839344 | 158830 | 0 | None | -10 | 8 | Human | 8.5 | pEC50 | = | 8.5 | 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 | 158830 | 0 | None | -10 | 8 | Human | 8.5 | pEC50 | = | 8.5 | 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 | ||
44235519 | 154984 | 0 | None | -42 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 411 | 8 | 1 | 4 | 5.2 | Cc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3935924 | 154984 | 0 | None | -42 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 411 | 8 | 1 | 4 | 5.2 | Cc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)cc1 | 10.1021/acs.jmedchem.6b00871 | ||
11502897 | 149571 | 0 | None | -933 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 431 | 11 | 2 | 5 | 4.8 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3892847 | 149571 | 0 | None | -933 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 431 | 11 | 2 | 5 | 4.8 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
11502897 | 149571 | 0 | None | -933 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 431 | 11 | 2 | 5 | 4.8 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3892847 | 149571 | 0 | None | -933 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 431 | 11 | 2 | 5 | 4.8 | CCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
44234532 | 157004 | 0 | None | -31 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 397 | 8 | 1 | 4 | 4.9 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3952237 | 157004 | 0 | None | -31 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 397 | 8 | 1 | 4 | 4.9 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
16725337 | 156380 | 0 | None | -21 | 4 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 443 | 12 | 2 | 4 | 6.0 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3947001 | 156380 | 0 | None | -21 | 4 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 443 | 12 | 2 | 4 | 6.0 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
16725337 | 156380 | 0 | None | -21 | 4 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 443 | 12 | 2 | 4 | 6.0 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3947001 | 156380 | 0 | None | -21 | 4 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 443 | 12 | 2 | 4 | 6.0 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
44234032 | 153216 | 0 | None | -154 | 3 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3922000 | 153216 | 0 | None | -154 | 3 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
118727307 | 124200 | 0 | None | -2 | 3 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 502 | 7 | 1 | 5 | 5.1 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | ||
CHEMBL3398228 | 124200 | 0 | None | -2 | 3 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 502 | 7 | 1 | 5 | 5.1 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | ||
44235755 | 160487 | 0 | None | -630 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(F)c(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3981509 | 160487 | 0 | None | -630 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(F)c(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
44235291 | 158710 | 0 | None | -363 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2cccc(Cl)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3966307 | 158710 | 0 | None | -363 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2cccc(Cl)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
11855865 | 160056 | 0 | None | -478 | 3 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 445 | 12 | 2 | 5 | 5.2 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3977724 | 160056 | 0 | None | -478 | 3 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 445 | 12 | 2 | 5 | 5.2 | CCCCCCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
44235520 | 159737 | 0 | None | -102 | 3 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(F)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3975122 | 159737 | 0 | None | -102 | 3 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(F)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
11855867 | 152761 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 389 | 8 | 2 | 5 | 3.6 | CCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3918349 | 152761 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 389 | 8 | 2 | 5 | 3.6 | CCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
11855867 | 152761 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 389 | 8 | 2 | 5 | 3.6 | CCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3918349 | 152761 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 389 | 8 | 2 | 5 | 3.6 | CCC(O)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 | nan | ||
11855870 | 153058 | 0 | None | -1548 | 3 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 427 | 11 | 1 | 4 | 5.7 | CCCCCC(=O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3920756 | 153058 | 0 | None | -1548 | 3 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 427 | 11 | 1 | 4 | 5.7 | CCCCCC(=O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
11855870 | 153058 | 0 | None | -1548 | 3 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 427 | 11 | 1 | 4 | 5.7 | CCCCCC(=O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
CHEMBL3920756 | 153058 | 0 | None | -1548 | 3 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 427 | 11 | 1 | 4 | 5.7 | CCCCCC(=O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 | nan | ||
44232565 | 160751 | 0 | None | -95 | 3 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(F)cc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3983767 | 160751 | 0 | None | -95 | 3 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(F)cc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
44219292 | 119359 | 38 | None | -89 | 3 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3301604 | 119359 | 38 | None | -89 | 3 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
44233521 | 157033 | 0 | None | -81 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3952439 | 157033 | 0 | None | -81 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 433 | 8 | 1 | 4 | 5.1 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
44219292 | 152866 | 38 | None | -35 | 3 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
CHEMBL3919269 | 152866 | 38 | None | -35 | 3 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | ||
11540010 | 63723 | 0 | None | - | 1 | Human | 10.7 | pIC50 | = | 10.7 | Functional | ChEMBL | 467 | 8 | 2 | 5 | 5.3 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(F)(F)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644207 | 63723 | 0 | None | - | 1 | Human | 10.7 | pIC50 | = | 10.7 | Functional | ChEMBL | 467 | 8 | 2 | 5 | 5.3 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(F)(F)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11584210 | 63730 | 0 | None | - | 1 | Human | 10.3 | pIC50 | = | 10.3 | Functional | ChEMBL | 501 | 8 | 2 | 6 | 5.2 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C3(C(=O)O)CCOCC3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644214 | 63730 | 0 | None | - | 1 | Human | 10.3 | pIC50 | = | 10.3 | Functional | ChEMBL | 501 | 8 | 2 | 6 | 5.2 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C3(C(=O)O)CCOCC3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
3356 | 9060 | 73 | None | 165 | 2 | Human | 10.1 | pIC50 | = | 10.1 | 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 | 9060 | 73 | None | 165 | 2 | Human | 10.1 | pIC50 | = | 10.1 | 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 | 9060 | 73 | None | 165 | 2 | Human | 10.1 | pIC50 | = | 10.1 | 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 | 9060 | 73 | None | 165 | 2 | Human | 10.1 | pIC50 | = | 10.1 | 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 | 9060 | 73 | None | 165 | 2 | Human | 10.1 | pIC50 | = | 10.1 | 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 | ||
53324506 | 63722 | 0 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Functional | ChEMBL | 491 | 8 | 2 | 7 | 4.8 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(F)(F)c3nnn[nH]3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644206 | 63722 | 0 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Functional | ChEMBL | 491 | 8 | 2 | 7 | 4.8 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(F)(F)c3nnn[nH]3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
44138108 | 191064 | 0 | None | 7413 | 2 | Human | 9.9 | pIC50 | = | 9.9 | 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 | 191064 | 0 | None | 7413 | 2 | Human | 9.9 | pIC50 | = | 9.9 | 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 | ||
24765153 | 191308 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | 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 | ||
CHEMBL484778 | 191308 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | 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 | ||
11597294 | 172955 | 4 | None | 33 | 2 | Human | 9.6 | pIC50 | = | 9.6 | 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 | 172955 | 4 | None | 33 | 2 | Human | 9.6 | pIC50 | = | 9.6 | 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 | ||
11269563 | 148388 | 0 | None | 676 | 2 | Human | 9.5 | pIC50 | = | 9.5 | 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 | 148388 | 0 | None | 676 | 2 | Human | 9.5 | pIC50 | = | 9.5 | 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 | ||
53320527 | 63729 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 417 | 7 | 2 | 5 | 4.8 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644213 | 63729 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 417 | 7 | 2 | 5 | 4.8 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11669780 | 63762 | 34 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 459 | 8 | 2 | 5 | 5.5 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644245 | 63762 | 34 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 459 | 8 | 2 | 5 | 5.5 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
53320526 | 63727 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 483 | 8 | 2 | 7 | 5.0 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)c3nnn[nH]3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644211 | 63727 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 483 | 8 | 2 | 7 | 5.0 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)c3nnn[nH]3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
53319216 | 63744 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 403 | 8 | 2 | 8 | 3.0 | COc1ccc(CCNc2cc(-c3cccc(-c4nnn[nH]4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644227 | 63744 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 403 | 8 | 2 | 8 | 3.0 | COc1ccc(CCNc2cc(-c3cccc(-c4nnn[nH]4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11696919 | 63764 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 397 | 8 | 2 | 6 | 3.7 | COc1ccc(CCNc2cc(-c3ccc(F)c(C(=O)O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644247 | 63764 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 397 | 8 | 2 | 6 | 3.7 | COc1ccc(CCNc2cc(-c3ccc(F)c(C(=O)O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
53316574 | 63724 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 477 | 8 | 2 | 5 | 5.6 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cc(C(C)(C)C(=O)O)ccc2F)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644208 | 63724 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 477 | 8 | 2 | 5 | 5.6 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cc(C(C)(C)C(=O)O)ccc2F)n1 | 10.1016/j.bmcl.2010.11.071 | ||
53316575 | 63728 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 485 | 8 | 2 | 5 | 6.0 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C3(C(=O)O)CCCC3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644212 | 63728 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 485 | 8 | 2 | 5 | 6.0 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C3(C(=O)O)CCCC3)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
53325847 | 63771 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 433 | 9 | 2 | 9 | 3.0 | COc1ccc(CCNc2cc(-c3ccc(OC)c(-c4nnn[nH]4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644253 | 63771 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 433 | 9 | 2 | 9 | 3.0 | COc1ccc(CCNc2cc(-c3ccc(OC)c(-c4nnn[nH]4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56661509 | 71205 | 0 | None | - | 1 | Mouse | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 506 | 6 | 1 | 6 | 4.8 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813277 | 71205 | 0 | None | - | 1 | Mouse | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 506 | 6 | 1 | 6 | 4.8 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | ||
54764763 | 75016 | 0 | None | 11 | 2 | Mouse | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C(C)(C)C(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915863 | 75016 | 0 | None | 11 | 2 | Mouse | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C(C)(C)C(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
11717959 | 63733 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 385 | 7 | 2 | 5 | 3.8 | COc1nc(NCCc2ccc(F)cc2F)cc(-c2cccc(C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644217 | 63733 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 385 | 7 | 2 | 5 | 3.8 | COc1nc(NCCc2ccc(F)cc2F)cc(-c2cccc(C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
10206535 | 73346 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL185251 | 73346 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
11660493 | 63741 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 360 | 7 | 1 | 6 | 3.7 | COc1ccc(CCNc2cc(-c3cccc(C#N)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644224 | 63741 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 360 | 7 | 1 | 6 | 3.7 | COc1ccc(CCNc2cc(-c3cccc(C#N)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
9803349 | 112185 | 2 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | 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/jm0205189 | ||
CHEMBL311790 | 112185 | 2 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | 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/jm0205189 | ||
57394587 | 75018 | 0 | None | 6 | 2 | Mouse | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C2(C(=O)O)CC2)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915865 | 75018 | 0 | None | 6 | 2 | Mouse | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C2(C(=O)O)CC2)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
9867949 | 17291 | 24 | None | 151 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | 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 | 17291 | 24 | None | 151 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | 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 | ||
10299717 | 71191 | 0 | None | - | 1 | Mouse | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813120 | 71191 | 0 | None | - | 1 | Mouse | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
56658146 | 71593 | 0 | None | - | 1 | Mouse | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1ccc(F)c(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819617 | 71593 | 0 | None | - | 1 | Mouse | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1ccc(F)c(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
10116114 | 132664 | 0 | None | -3 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL364841 | 132664 | 0 | None | -3 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
57401554 | 75019 | 0 | None | - | 1 | Mouse | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 536 | 7 | 2 | 5 | 5.7 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(F)(F)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915866 | 75019 | 0 | None | - | 1 | Mouse | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 536 | 7 | 2 | 5 | 5.7 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(F)(F)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
11431240 | 75011 | 0 | None | - | 1 | Mouse | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 465 | 7 | 2 | 4 | 5.4 | Cc1cc(OC[C@@H]2COc3ccccc32)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915858 | 75011 | 0 | None | - | 1 | Mouse | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 465 | 7 | 2 | 4 | 5.4 | Cc1cc(OC[C@@H]2COc3ccccc32)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
53358922 | 71204 | 0 | None | - | 1 | Mouse | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813276 | 71204 | 0 | None | - | 1 | Mouse | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
10228100 | 71188 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813118 | 71188 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
56681899 | 71217 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 473 | 6 | 1 | 5 | 5.3 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813289 | 71217 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 473 | 6 | 1 | 5 | 5.3 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | ||
56675400 | 71591 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819615 | 71591 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.007 | ||
56675400 | 71591 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819615 | 71591 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.065 | ||
10741899 | 17290 | 0 | None | 616 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | 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 | 17290 | 0 | None | 616 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | 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 | ||
53325827 | 63745 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1ccc(CCNc2cc(-c3cccnc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644228 | 63745 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1ccc(CCNc2cc(-c3cccnc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
10183680 | 133944 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL365696 | 133944 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
11567324 | 63777 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 391 | 8 | 1 | 6 | 4.8 | COc1ccc(CCNc2cc(-c3ccc(C(F)F)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644259 | 63777 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 391 | 8 | 1 | 6 | 4.8 | COc1ccc(CCNc2cc(-c3ccc(C(F)F)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
44460832 | 170869 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 451 | 9 | 2 | 3 | 6.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc(-c4ccccc4)c3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL420956 | 170869 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 451 | 9 | 2 | 3 | 6.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc(-c4ccccc4)c3)[C@@H]1C2 | 10.1021/jm0205189 | ||
10885393 | 212386 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 485 | 11 | 2 | 4 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)s1 | 10.1021/jm020517g | ||
CHEMBL81600 | 212386 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 485 | 11 | 2 | 4 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)s1 | 10.1021/jm020517g | ||
134144574 | 157597 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 469 | 8 | 1 | 7 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
CHEMBL3956848 | 157597 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 469 | 8 | 1 | 7 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
134152908 | 160109 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 515 | 9 | 1 | 8 | 3.4 | Cc1cnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | ||
CHEMBL3978260 | 160109 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 515 | 9 | 1 | 8 | 3.4 | Cc1cnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | ||
46853755 | 75306 | 1 | None | -380 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 406 | 6 | 1 | 4 | 3.7 | CCCS(=O)(=O)c1ccc(C)c(C#Cc2cc(Cl)ccc2OCC(=O)O)c1 | 10.1021/jm200866y | ||
CHEMBL1917584 | 75306 | 1 | None | -380 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 406 | 6 | 1 | 4 | 3.7 | CCCS(=O)(=O)c1ccc(C)c(C#Cc2cc(Cl)ccc2OCC(=O)O)c1 | 10.1021/jm200866y | ||
53317887 | 63734 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 404 | 8 | 2 | 6 | 4.3 | COc1cccc(-c2cc(NCCc3c[nH]c4cc(OC)ccc34)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644218 | 63734 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 404 | 8 | 2 | 6 | 4.3 | COc1cccc(-c2cc(NCCc3c[nH]c4cc(OC)ccc34)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
53326808 | 63738 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 351 | 7 | 1 | 6 | 3.8 | COc1ccc(CNc2cc(-c3cccc(OC)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644221 | 63738 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 351 | 7 | 1 | 6 | 3.8 | COc1ccc(CNc2cc(-c3cccc(OC)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
44460730 | 111549 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 372 | 8 | 2 | 3 | 4.0 | Cn1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1 | 10.1021/jm0205189 | ||
CHEMBL310830 | 111549 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 372 | 8 | 2 | 3 | 4.0 | Cn1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1 | 10.1021/jm0205189 | ||
44461024 | 113880 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 408 | 8 | 3 | 2 | 5.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3c[nH]c4ccccc34)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL315977 | 113880 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 408 | 8 | 3 | 2 | 5.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3c[nH]c4ccccc34)[C@@H]1C2 | 10.1021/jm0205189 | ||
44460813 | 212394 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 414 | 9 | 2 | 4 | 4.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL81654 | 212394 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 414 | 9 | 2 | 4 | 4.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
134147075 | 156471 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 502 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(C(F)(F)F)c3)CC2)cc1 | nan | ||
CHEMBL3947705 | 156471 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 502 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(C(F)(F)F)c3)CC2)cc1 | nan | ||
134154584 | 159108 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 491 | 9 | 2 | 7 | 1.8 | CNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3969800 | 159108 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 491 | 9 | 2 | 7 | 1.8 | CNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
134157343 | 160564 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3982208 | 160564 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11294449 | 75001 | 0 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(C)c1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915673 | 75001 | 0 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(C)c1C | 10.1016/j.bmc.2011.08.065 | ||
53323153 | 63748 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 395 | 10 | 1 | 7 | 3.7 | COc1ccc(CCNc2cc(OCc3ccccc3OC)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644231 | 63748 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 395 | 10 | 1 | 7 | 3.7 | COc1ccc(CCNc2cc(OCc3ccccc3OC)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11502665 | 63768 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 420 | 8 | 1 | 7 | 3.7 | COc1ccc(CCNc2cc(-c3ccc(N4CCOCC4)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644250 | 63768 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 420 | 8 | 1 | 7 | 3.7 | COc1ccc(CCNc2cc(-c3ccc(N4CCOCC4)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11717787 | 63775 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 3.8 | COc1ccc(CCNc2cc(-c3ccc4c(c3)CCO4)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644257 | 63775 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 3.8 | COc1ccc(CCNc2cc(-c3ccc4c(c3)CCO4)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
134146965 | 156436 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 583 | 11 | 3 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cc(C5CC5)n[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3947427 | 156436 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 583 | 11 | 3 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cc(C5CC5)n[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11315933 | 130072 | 4 | None | - | 1 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 413 | 7 | 1 | 4 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL361457 | 130072 | 4 | None | - | 1 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 413 | 7 | 1 | 4 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
11005555 | 212415 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL81768 | 212415 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 | 10.1021/jm020517g | ||
10767455 | 112587 | 0 | None | 16 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | 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 | 112587 | 0 | None | 16 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | 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 | ||
134145757 | 155957 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 510 | 9 | 1 | 6 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccccc4)c3)CC2)cc1 | nan | ||
CHEMBL3943681 | 155957 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 510 | 9 | 1 | 6 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccccc4)c3)CC2)cc1 | nan | ||
134136547 | 149477 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 478 | 9 | 2 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(NCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3892146 | 149477 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 478 | 9 | 2 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(NCC(=O)O)c3)CC2)cc1 | nan | ||
134146324 | 155952 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 560 | 10 | 2 | 9 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3943626 | 155952 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 560 | 10 | 2 | 9 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11811847 | 212410 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 9 | 2 | 3 | 4.5 | Cc1cc(C)c(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)c(C)c1 | 10.1021/jm020517g | ||
CHEMBL81751 | 212410 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 419 | 9 | 2 | 3 | 4.5 | Cc1cc(C)c(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)c(C)c1 | 10.1021/jm020517g | ||
134135286 | 150728 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 476 | 9 | 1 | 7 | 2.7 | CC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3902404 | 150728 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 476 | 9 | 1 | 7 | 2.7 | CC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
21974331 | 133324 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 6 | 1 | 4 | 4.8 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL365243 | 133324 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 399 | 6 | 1 | 4 | 4.8 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
11465472 | 75012 | 0 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 465 | 7 | 2 | 4 | 5.2 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915859 | 75012 | 0 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 465 | 7 | 2 | 4 | 5.2 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
11640888 | 63763 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 446 | 8 | 1 | 8 | 2.9 | COC(=O)Cn1cc(-c2cc(NCCc3c(F)cccc3Cl)nc(OC)n2)ccc1=O | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644246 | 63763 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 446 | 8 | 1 | 8 | 2.9 | COC(=O)Cn1cc(-c2cc(NCCc3c(F)cccc3Cl)nc(OC)n2)ccc1=O | 10.1016/j.bmcl.2010.11.071 | ||
134144853 | 157359 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3955068 | 157359 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134133522 | 150265 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)ccc3Cl)CC2)cc1 | nan | ||
CHEMBL3898628 | 150265 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)ccc3Cl)CC2)cc1 | nan | ||
11269563 | 148388 | 0 | None | 676 | 2 | Human | 7.8 | pIC50 | = | 7.8 | 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 | 148388 | 0 | None | 676 | 2 | Human | 7.8 | pIC50 | = | 7.8 | 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 | ||
44460692 | 170866 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 375 | 8 | 2 | 3 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cccs3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL420953 | 170866 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 375 | 8 | 2 | 3 | 4.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cccs3)[C@@H]1C2 | 10.1021/jm0205189 | ||
134144732 | 157320 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 531 | 11 | 2 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3954700 | 157320 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 531 | 11 | 2 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134155549 | 157901 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 502 | 9 | 1 | 7 | 2.4 | COCC#Cc1cc(OCC(=O)O)cc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1 | nan | ||
CHEMBL3959289 | 157901 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 502 | 9 | 1 | 7 | 2.4 | COCC#Cc1cc(OCC(=O)O)cc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1 | nan | ||
135509970 | 63754 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 351 | 7 | 2 | 6 | 3.5 | COc1ccc(CCNc2cc(-c3ccccc3O)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644237 | 63754 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 351 | 7 | 2 | 6 | 3.5 | COc1ccc(CCNc2cc(-c3ccccc3O)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
134146220 | 155903 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 467 | 8 | 1 | 5 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3943291 | 155903 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 467 | 8 | 1 | 5 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11762410 | 212129 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | 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)c1ccc2c(c1)oc1ccccc12 | 10.1021/jm020517g | ||
CHEMBL79669 | 212129 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | 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)c1ccc2c(c1)oc1ccccc12 | 10.1021/jm020517g | ||
10874325 | 212591 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 468 | 11 | 3 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Nc2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL83269 | 212591 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 468 | 11 | 3 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Nc2ccccc2)cc1 | 10.1021/jm020517g | ||
134135732 | 151077 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 465 | 9 | 1 | 5 | 3.9 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(F)cc3CCC(=O)O)CC2)cc1 | nan | ||
CHEMBL3905238 | 151077 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 465 | 9 | 1 | 5 | 3.9 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(F)cc3CCC(=O)O)CC2)cc1 | nan | ||
134145262 | 155594 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 557 | 11 | 2 | 8 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3940951 | 155594 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 557 | 11 | 2 | 8 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
53321836 | 63721 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 349 | 8 | 1 | 5 | 4.2 | COc1cccc(-c2cc(NCCCc3ccccc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644205 | 63721 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 349 | 8 | 1 | 5 | 4.2 | COc1cccc(-c2cc(NCCCc3ccccc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
44460923 | 212491 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 373 | 9 | 2 | 3 | 4.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)Cc3ccoc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL82468 | 212491 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 373 | 9 | 2 | 3 | 4.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)Cc3ccoc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
44460691 | 212158 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 413 | 8 | 2 | 4 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4c(c3)OCO4)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL79941 | 212158 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 413 | 8 | 2 | 4 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4c(c3)OCO4)[C@@H]1C2 | 10.1021/jm0205189 | ||
11038515 | 212488 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 510 | 10 | 2 | 5 | 5.5 | CN(C)c1ccc2c(c1)oc1ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc12 | 10.1021/jm020517g | ||
CHEMBL82426 | 212488 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 510 | 10 | 2 | 5 | 5.5 | CN(C)c1ccc2c(c1)oc1ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc12 | 10.1021/jm020517g | ||
134155925 | 157695 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 535 | 10 | 2 | 8 | 3.4 | CC(C)OC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3957668 | 157695 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 535 | 10 | 2 | 8 | 3.4 | CC(C)OC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
134142097 | 153989 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 534 | 10 | 3 | 7 | 3.0 | CC(C)NC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3928254 | 153989 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 534 | 10 | 3 | 7 | 3.0 | CC(C)NC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
44460939 | 212737 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | 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/jm0205189 | ||
CHEMBL84452 | 212737 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | 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/jm0205189 | ||
134141795 | 153856 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3927215 | 153856 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10961840 | 86328 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C\c2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL2114171 | 86328 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C\c2ccccc2)cc1 | 10.1021/jm020517g | ||
11070932 | 112738 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 9 | 2 | 4 | 5.9 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2sc3ccccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL312983 | 112738 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 9 | 2 | 4 | 5.9 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2sc3ccccc3c2c1 | 10.1021/jm020517g | ||
10939814 | 212061 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1cc2oc3ccccc3c2cc1O | 10.1021/jm020517g | ||
CHEMBL79095 | 212061 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1cc2oc3ccccc3c2cc1O | 10.1021/jm020517g | ||
10961839 | 212500 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL82537 | 212500 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)cc1 | 10.1021/jm020517g | ||
134136114 | 151089 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 477 | 9 | 2 | 7 | 1.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(N)=O)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3905338 | 151089 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 477 | 9 | 2 | 7 | 1.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(N)=O)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
57391066 | 75017 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(C(=O)Nc2cc(C3(C(=O)O)CC3)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915864 | 75017 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(C(=O)Nc2cc(C3(C(=O)O)CC3)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
11812883 | 112303 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 483 | 10 | 2 | 5 | 4.9 | O=C(O)CCCCC(=O)C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL312182 | 112303 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 483 | 10 | 2 | 5 | 4.9 | O=C(O)CCCCC(=O)C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
44460415 | 111184 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cc1 | 10.1021/jm0205189 | ||
CHEMBL310304 | 111184 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cc1 | 10.1021/jm0205189 | ||
11005693 | 212089 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 506 | 10 | 2 | 4 | 5.7 | Cn1c(-c2ccccc2)cc2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc21 | 10.1021/jm020517g | ||
CHEMBL79320 | 212089 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 506 | 10 | 2 | 4 | 5.7 | Cn1c(-c2ccccc2)cc2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc21 | 10.1021/jm020517g | ||
11294166 | 83820 | 0 | None | 10232 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | 83820 | 0 | None | 10232 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | ||
11408533 | 148105 | 0 | None | 2089 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | 148105 | 0 | None | 2089 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | ||
11294166 | 83820 | 0 | None | 10232 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | 83820 | 0 | None | 10232 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | ||
11408533 | 148105 | 0 | None | 2089 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | 148105 | 0 | None | 2089 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | ||
44138108 | 191064 | 0 | None | 7413 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | 191064 | 0 | None | 7413 | 2 | Human | 8.7 | pIC50 | = | 8.7 | 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 | ||
10278907 | 71192 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813121 | 71192 | 0 | None | - | 1 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | ||
53358921 | 71215 | 0 | None | 3467 | 2 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | 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 | 71215 | 0 | None | 3467 | 2 | Mouse | 8.7 | pIC50 | = | 8.7 | Functional | 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 | ||
53318738 | 63773 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 378 | 8 | 2 | 6 | 2.9 | COc1ccc(CCNc2cc(-c3ccc(C(N)=O)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644255 | 63773 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 378 | 8 | 2 | 6 | 2.9 | COc1ccc(CCNc2cc(-c3ccc(C(N)=O)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11690028 | 63778 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 408 | 8 | 1 | 8 | 4.5 | COc1ccc(CCNc2cc(-c3ccc(-c4cnco4)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644260 | 63778 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 408 | 8 | 1 | 8 | 4.5 | COc1ccc(CCNc2cc(-c3ccc(-c4cnco4)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
10116114 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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 | ||
10116114 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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.2011.08.065 | ||
CHEMBL364841 | 132664 | 0 | None | 3 | 2 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | 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.2011.08.065 | ||
56681885 | 71193 | 0 | None | - | 1 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813122 | 71193 | 0 | None | - | 1 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | ||
11488860 | 26063 | 0 | None | 7762 | 2 | Human | 8.6 | pIC50 | = | 8.6 | 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 | 26063 | 0 | None | 7762 | 2 | Human | 8.6 | pIC50 | = | 8.6 | 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 | ||
11697378 | 63752 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 417 | 8 | 1 | 8 | 4.2 | COc1ccc(CCNc2cc(-c3cccc(-c4nc(C)no4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644235 | 63752 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 417 | 8 | 1 | 8 | 4.2 | COc1ccc(CCNc2cc(-c3cccc(-c4nc(C)no4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
53324534 | 63774 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 402 | 8 | 1 | 7 | 4.5 | COc1ccc(CCNc2cc(-c3cccc(-c4cnco4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644256 | 63774 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 402 | 8 | 1 | 7 | 4.5 | COc1ccc(CCNc2cc(-c3cccc(-c4cnco4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
53323151 | 63720 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 473 | 9 | 2 | 5 | 5.6 | COCc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644204 | 63720 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 473 | 9 | 2 | 5 | 5.6 | COCc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
56681898 | 71209 | 0 | None | - | 1 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813281 | 71209 | 0 | None | - | 1 | Mouse | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
10599289 | 20914 | 0 | None | 213 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | 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 | 20914 | 0 | None | 213 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Functional | 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 | ||
11502516 | 63755 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 414 | 8 | 2 | 7 | 2.5 | COc1ccc(CCNc2cc(-c3cccc(S(N)(=O)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644238 | 63755 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 414 | 8 | 2 | 7 | 2.5 | COc1ccc(CCNc2cc(-c3cccc(S(N)(=O)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56661652 | 71584 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819609 | 71584 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
56658147 | 71594 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 476 | 8 | 2 | 6 | 4.2 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819618 | 71594 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 476 | 8 | 2 | 6 | 4.2 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
56661652 | 71584 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819609 | 71584 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
44460962 | 112206 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1sccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
CHEMBL311977 | 112206 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1sccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
134132110 | 151422 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 8 | 1 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C#N)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3908130 | 151422 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 8 | 1 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C#N)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11059671 | 111645 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 465 | 10 | 2 | 5 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2cccs2)s1 | 10.1021/jm020517g | ||
CHEMBL311038 | 111645 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 465 | 10 | 2 | 5 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2cccs2)s1 | 10.1021/jm020517g | ||
10928987 | 170734 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 483 | 11 | 2 | 4 | 5.3 | COc1ccc(-c2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc2)cc1 | 10.1021/jm020517g | ||
CHEMBL420777 | 170734 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 483 | 11 | 2 | 4 | 5.3 | COc1ccc(-c2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc2)cc1 | 10.1021/jm020517g | ||
91981657 | 152742 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ncco4)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
CHEMBL3918212 | 152742 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ncco4)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
134150792 | 158751 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 519 | 11 | 2 | 7 | 2.6 | CCCNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3966654 | 158751 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 519 | 11 | 2 | 7 | 2.6 | CCCNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
134148733 | 155324 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 593 | 10 | 3 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nc5ccccc5[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3938696 | 155324 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 593 | 10 | 3 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nc5ccccc5[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11123848 | 111183 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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)c1ccc(-c2cc3ccccc3[nH]2)cc1 | 10.1021/jm020517g | ||
CHEMBL310301 | 111183 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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)c1ccc(-c2cc3ccccc3[nH]2)cc1 | 10.1021/jm020517g | ||
10552612 | 212495 | 0 | None | 3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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/jm020517g | ||
CHEMBL82489 | 212495 | 0 | None | 3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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/jm020517g | ||
134139245 | 152926 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 475 | 9 | 1 | 6 | 3.8 | COc1cccc(OC2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1/C=C/C(=O)O | nan | ||
CHEMBL3919756 | 152926 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 475 | 9 | 1 | 6 | 3.8 | COc1cccc(OC2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1/C=C/C(=O)O | nan | ||
134144455 | 157286 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 517 | 10 | 2 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3954499 | 157286 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 517 | 10 | 2 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
118134876 | 158334 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 516 | 9 | 1 | 9 | 2.8 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | ||
CHEMBL3963140 | 158334 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 516 | 9 | 1 | 9 | 2.8 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | ||
53324509 | 63759 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 386 | 6 | 1 | 7 | 3.5 | COc1nc(NCCc2ccc3c(c2)OC(F)(F)O3)cc(-c2cccnc2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644242 | 63759 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 386 | 6 | 1 | 7 | 3.5 | COc1nc(NCCc2ccc3c(c2)OC(F)(F)O3)cc(-c2cccnc2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11646256 | 63761 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 363 | 8 | 1 | 5 | 4.4 | CCc1nc(NCCc2ccc(OC)cc2)cc(-c2cccc(OC)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644244 | 63761 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 363 | 8 | 1 | 5 | 4.4 | CCc1nc(NCCc2ccc(OC)cc2)cc(-c2cccc(OC)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11178659 | 74998 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cccc(CC(=O)O)c2)c1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915670 | 74998 | 0 | None | - | 1 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cccc(CC(=O)O)c2)c1C | 10.1016/j.bmc.2011.08.065 | ||
44461053 | 212134 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | 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/jm0205189 | ||
CHEMBL79700 | 212134 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | 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/jm0205189 | ||
11081118 | 112600 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 9 | 3 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2[nH]c3ccccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL312715 | 112600 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 466 | 9 | 3 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2[nH]c3ccccc3c2c1 | 10.1021/jm020517g | ||
10025456 | 120772 | 0 | None | 14 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | 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 | 120772 | 0 | None | 14 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | 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 | ||
53321438 | 63758 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 433 | 7 | 2 | 6 | 4.2 | COc1nc(NCC2OCCc3ccccc32)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644241 | 63758 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 433 | 7 | 2 | 6 | 4.2 | COc1nc(NCC2OCCc3ccccc32)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11224239 | 71578 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819603 | 71578 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
11224239 | 71578 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819603 | 71578 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
11026912 | 111336 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 10 | 2 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)s1 | 10.1021/jm020517g | ||
CHEMBL310454 | 111336 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 10 | 2 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)s1 | 10.1021/jm020517g | ||
10813802 | 20561 | 0 | None | 3 | 3 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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 | 20561 | 0 | None | 3 | 3 | Human | 6.7 | pIC50 | = | 6.7 | Functional | 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 | ||
11597294 | 172955 | 4 | None | 33 | 2 | Human | 7.6 | pIC50 | = | 7.6 | 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 | 172955 | 4 | None | 33 | 2 | Human | 7.6 | pIC50 | = | 7.6 | 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 | ||
134140560 | 153517 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Br)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3924249 | 153517 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Br)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
134149663 | 155041 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 518 | 9 | 1 | 9 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3936481 | 155041 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 518 | 9 | 1 | 9 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
44460960 | 212170 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cscc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
CHEMBL80002 | 212170 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cscc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
134132925 | 151890 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 510 | 9 | 1 | 6 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3911819 | 151890 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 510 | 9 | 1 | 6 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134146722 | 155919 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 526 | 10 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Oc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3943396 | 155919 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 526 | 10 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Oc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134149910 | 158769 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 435 | 8 | 1 | 7 | 1.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cccc(OCC(=O)O)n3)CC2)cc1 | nan | ||
CHEMBL3966776 | 158769 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 435 | 8 | 1 | 7 | 1.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cccc(OCC(=O)O)n3)CC2)cc1 | nan | ||
11375038 | 75020 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 479 | 7 | 2 | 4 | 5.7 | Cc1ccc2c(c1)[C@H](COc1cc(C)c(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(C)c1)CO2 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915867 | 75020 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 479 | 7 | 2 | 4 | 5.7 | Cc1ccc2c(c1)[C@H](COc1cc(C)c(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(C)c1)CO2 | 10.1016/j.bmc.2011.08.065 | ||
44460740 | 112209 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 385 | 8 | 3 | 3 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc(O)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL311999 | 112209 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 385 | 8 | 3 | 3 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc(O)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
134136718 | 149379 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 500 | 9 | 1 | 8 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-n4cccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3891367 | 149379 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 500 | 9 | 1 | 8 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-n4cccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134142398 | 152585 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 445 | 8 | 1 | 5 | 3.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccccc3/C=C/C(=O)O)CC2)cc1 | nan | ||
CHEMBL3917020 | 152585 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 445 | 8 | 1 | 5 | 3.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccccc3/C=C/C(=O)O)CC2)cc1 | nan | ||
134139132 | 152834 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 568 | 11 | 2 | 8 | 2.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3918994 | 152834 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 568 | 11 | 2 | 8 | 2.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
53317523 | 63735 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1cccc(-c2cc(NCCc3cccnc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644219 | 63735 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1cccc(-c2cc(NCCc3cccnc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
53325848 | 63780 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 425 | 9 | 2 | 7 | 4.2 | COc1ccc(CCNc2cc(-c3cccc(C(=O)O)c3)nc(SC)n2)cc1OC | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644262 | 63780 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 425 | 9 | 2 | 7 | 4.2 | COc1ccc(CCNc2cc(-c3cccc(C(=O)O)c3)nc(SC)n2)cc1OC | 10.1016/j.bmcl.2010.11.071 | ||
44460814 | 212342 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | ||
CHEMBL81231 | 212342 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | ||
10896473 | 212032 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 10 | 4 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccc(O)cc3)[nH]c2c1 | 10.1021/jm020517g | ||
CHEMBL78904 | 212032 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 10 | 4 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccc(O)cc3)[nH]c2c1 | 10.1021/jm020517g | ||
53324544 | 63348 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 325 | 7 | 2 | 6 | 2.5 | COc1ccc(CCNc2cc(-c3cn[nH]c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1641628 | 63348 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 325 | 7 | 2 | 6 | 2.5 | COc1ccc(CCNc2cc(-c3cn[nH]c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
16038404 | 153832 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 470 | 8 | 1 | 6 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3926982 | 153832 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 470 | 8 | 1 | 6 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
21974448 | 73737 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL186735 | 73737 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
10885356 | 111426 | 1 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccc(O)cc3c2c1 | 10.1021/jm020517g | ||
CHEMBL310505 | 111426 | 1 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccc(O)cc3c2c1 | 10.1021/jm020517g | ||
10553794 | 170417 | 0 | None | 14 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm970343g | ||
CHEMBL420398 | 170417 | 0 | None | 14 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm970343g | ||
10552612 | 212495 | 0 | None | 3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | 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 | 212495 | 0 | None | 3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | 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 | ||
134155468 | 157929 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3959547 | 157929 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
57391066 | 75017 | 0 | None | -1 | 2 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(C(=O)Nc2cc(C3(C(=O)O)CC3)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915864 | 75017 | 0 | None | -1 | 2 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(C(=O)Nc2cc(C3(C(=O)O)CC3)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
11733560 | 111514 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 481 | 12 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(CCc2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL310643 | 111514 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 481 | 12 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(CCc2ccccc2)cc1 | 10.1021/jm020517g | ||
11374771 | 75013 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 7 | 2 | 5 | 5.0 | Cc1cc(OCC2Oc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915860 | 75013 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 7 | 2 | 5 | 5.0 | Cc1cc(OCC2Oc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
44394432 | 134104 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL365908 | 134104 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
59232361 | 154105 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 458 | 7 | 1 | 7 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc4ncn(CC(=O)O)c4c3)CC2)cc1 | nan | ||
CHEMBL3929181 | 154105 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 458 | 7 | 1 | 7 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc4ncn(CC(=O)O)c4c3)CC2)cc1 | nan | ||
134144246 | 157316 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 481 | 9 | 1 | 5 | 4.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(Cl)cc3CCC(=O)O)CC2)cc1 | nan | ||
CHEMBL3954675 | 157316 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 481 | 9 | 1 | 5 | 4.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(Cl)cc3CCC(=O)O)CC2)cc1 | nan | ||
56668528 | 71586 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1C | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819610 | 71586 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1C | 10.1016/j.bmc.2011.08.007 | ||
11259714 | 74999 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(C(=O)Nc2cccc(CC(=O)O)c2)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915671 | 74999 | 0 | None | - | 1 | Mouse | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(C(=O)Nc2cccc(CC(=O)O)c2)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
59232348 | 155017 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 479 | 9 | 1 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3936228 | 155017 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 479 | 9 | 1 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(OCC(=O)O)c3)CC2)cc1 | nan | ||
57391065 | 75014 | 0 | None | -39 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 528 | 7 | 2 | 5 | 5.9 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(C)(C)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915861 | 75014 | 0 | None | -39 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 528 | 7 | 2 | 5 | 5.9 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(C)(C)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
10917396 | 212419 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 452 | 11 | 2 | 6 | 3.5 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1[N+](=O)[O-] | 10.1021/jm020517g | ||
CHEMBL81804 | 212419 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 452 | 11 | 2 | 6 | 3.5 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1[N+](=O)[O-] | 10.1021/jm020517g | ||
11134192 | 212671 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | 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)c1cccc(-c2ccccc2)c1 | 10.1021/jm020517g | ||
CHEMBL83893 | 212671 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | 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)c1cccc(-c2ccccc2)c1 | 10.1021/jm020517g | ||
59232335 | 161049 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4cocn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3986455 | 161049 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4cocn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10185612 | 71187 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813117 | 71187 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
21893828 | 71216 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2CC1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813288 | 71216 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2CC1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | ||
10300724 | 71203 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813275 | 71203 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | ||
44461046 | 212159 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | 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/jm0205189 | ||
CHEMBL79943 | 212159 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | 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/jm0205189 | ||
56675398 | 71583 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819608 | 71583 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
56675398 | 71583 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819608 | 71583 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | ||
56672019 | 71588 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)c1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819612 | 71588 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)c1 | 10.1016/j.bmc.2011.08.007 | ||
11328662 | 75000 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915672 | 75000 | 0 | None | - | 1 | Mouse | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | ||
53321837 | 63732 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 385 | 7 | 1 | 5 | 4.4 | COc1nc(NCCc2c(F)cccc2Cl)cc(-c2cccc(C=O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644216 | 63732 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 385 | 7 | 1 | 5 | 4.4 | COc1nc(NCCc2c(F)cccc2Cl)cc(-c2cccc(C=O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
56664920 | 71210 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 471 | 6 | 1 | 6 | 4.8 | Cc1cc(OC[C@@H]2COc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813282 | 71210 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 471 | 6 | 1 | 6 | 4.8 | Cc1cc(OC[C@@H]2COc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
53320268 | 63757 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 8 | 1 | 7 | 4.1 | COc1ccc(CCNc2cc(-c3ccc(C(C)=O)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644240 | 63757 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 8 | 1 | 7 | 4.1 | COc1ccc(CCNc2cc(-c3ccc(C(C)=O)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56678743 | 71597 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819621 | 71597 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
44460938 | 112361 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 518 | 10 | 3 | 5 | 5.3 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(NS(C)(=O)=O)cc34)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL312216 | 112361 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 518 | 10 | 3 | 5 | 5.3 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(NS(C)(=O)=O)cc34)[C@@H]1C2 | 10.1021/jm0205189 | ||
21974528 | 131228 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL363984 | 131228 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
44394380 | 132207 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL364593 | 132207 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
21974374 | 134025 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL365829 | 134025 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
59232290 | 159522 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3973247 | 159522 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10361472 | 71982 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)cc3c(CC(=O)O)cccc32)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL182555 | 71982 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)cc3c(CC(=O)O)cccc32)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
134144966 | 157524 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 471 | 8 | 1 | 7 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
CHEMBL3956366 | 157524 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 471 | 8 | 1 | 7 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
134155709 | 157647 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 447 | 9 | 1 | 5 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccccc3CCC(=O)O)CC2)cc1 | nan | ||
CHEMBL3957292 | 157647 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 447 | 9 | 1 | 5 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccccc3CCC(=O)O)CC2)cc1 | nan | ||
134152460 | 159763 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3975257 | 159763 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
56678561 | 71208 | 0 | None | - | 1 | Mouse | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c1C | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813280 | 71208 | 0 | None | - | 1 | Mouse | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c1C | 10.1016/j.bmc.2011.06.014 | ||
57403305 | 75015 | 0 | None | 1 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(C(=O)Nc2cc(C(C)(C)C(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915862 | 75015 | 0 | None | 1 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(C(=O)Nc2cc(C(C)(C)C(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
10962613 | 110915 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 10 | 2 | 6 | 4.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL309443 | 110915 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 10 | 2 | 6 | 4.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
11619108 | 63739 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 441 | 9 | 1 | 7 | 4.6 | CCOC(=O)c1cc(-c2cc(NCCc3ccc(OC)cc3)nc(OC)n2)ccc1Cl | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644222 | 63739 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 441 | 9 | 1 | 7 | 4.6 | CCOC(=O)c1cc(-c2cc(NCCc3ccc(OC)cc3)nc(OC)n2)ccc1Cl | 10.1016/j.bmcl.2010.11.071 | ||
44460460 | 212321 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
CHEMBL81004 | 212321 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | ||
10951507 | 111118 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 525 | 10 | 2 | 5 | 6.1 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCC(C)(C)C(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
CHEMBL309999 | 111118 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 525 | 10 | 2 | 5 | 6.1 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCC(C)(C)C(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
10951130 | 111652 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC(C)(CC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(=O)O | 10.1021/jm020517g | ||
CHEMBL311105 | 111652 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC(C)(CC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(=O)O | 10.1021/jm020517g | ||
10696132 | 174903 | 0 | None | 21 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | 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/jm020517g | ||
CHEMBL432935 | 174903 | 0 | None | 21 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | 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/jm020517g | ||
10696132 | 174903 | 0 | None | 21 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | 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 | 174903 | 0 | None | 21 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | 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 | ||
10874929 | 112597 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 513 | 11 | 2 | 6 | 4.9 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1CC(=O)CCCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
CHEMBL312707 | 112597 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 513 | 11 | 2 | 6 | 4.9 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1CC(=O)CCCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
11071097 | 174588 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1ccc2oc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3c2c1 | 10.1021/jm020517g | ||
CHEMBL430627 | 174588 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1ccc2oc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3c2c1 | 10.1021/jm020517g | ||
10864153 | 212339 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 511 | 11 | 2 | 5 | 5.9 | CCOc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
CHEMBL81185 | 212339 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 511 | 11 | 2 | 5 | 5.9 | CCOc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
11091707 | 212327 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 455 | 9 | 2 | 3 | 4.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccccc1Br | 10.1021/jm020517g | ||
CHEMBL81050 | 212327 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 455 | 9 | 2 | 3 | 4.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccccc1Br | 10.1021/jm020517g | ||
44461194 | 212651 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 429 | 8 | 2 | 3 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4c3CCCC4)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL83788 | 212651 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 429 | 8 | 2 | 3 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4c3CCCC4)[C@@H]1C2 | 10.1021/jm0205189 | ||
11135113 | 112181 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 521 | 10 | 2 | 3 | 6.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 | 10.1021/jm020517g | ||
CHEMBL311769 | 112181 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 521 | 10 | 2 | 3 | 6.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 | 10.1021/jm020517g | ||
134145893 | 155600 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccno4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3940995 | 155600 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccno4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134147112 | 156690 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 448 | 8 | 1 | 6 | 2.8 | Cc1cc(OCC(=O)O)cc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1 | nan | ||
CHEMBL3949387 | 156690 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 448 | 8 | 1 | 6 | 2.8 | Cc1cc(OCC(=O)O)cc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1 | nan | ||
134140462 | 153400 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 561 | 10 | 2 | 10 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3923338 | 153400 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 561 | 10 | 2 | 10 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134148187 | 156833 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 517 | 9 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3950658 | 156833 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 517 | 9 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10595288 | 212097 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm0205189 | ||
CHEMBL79413 | 212097 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm0205189 | ||
10595288 | 212097 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | 212097 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | ||
134144104 | 157099 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 530 | 11 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(OCc4ccoc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3952933 | 157099 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 530 | 11 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(OCc4ccoc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
44460751 | 212517 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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/jm0205189 | ||
CHEMBL82655 | 212517 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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/jm0205189 | ||
44460942 | 212162 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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/jm0205189 | ||
CHEMBL79972 | 212162 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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/jm0205189 | ||
10547489 | 170113 | 0 | None | 8 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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 | 170113 | 0 | None | 8 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | 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 | ||
53321679 | 63731 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 427 | 8 | 2 | 5 | 4.7 | COc1nc(NCC(F)(F)c2ccccc2)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644215 | 63731 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 427 | 8 | 2 | 5 | 4.7 | COc1nc(NCC(F)(F)c2ccccc2)cc(-c2cccc(C(C)(C)C(=O)O)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
59232325 | 154030 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 482 | 9 | 1 | 6 | 3.5 | CC[C@@H](C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3928578 | 154030 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 482 | 9 | 1 | 6 | 3.5 | CC[C@@H](C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10552450 | 212090 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm0205189 | ||
CHEMBL79360 | 212090 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm0205189 | ||
11103335 | 168489 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 521 | 11 | 2 | 7 | 4.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2nnnn2-c2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL413523 | 168489 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 521 | 11 | 2 | 7 | 4.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2nnnn2-c2ccccc2)cc1 | 10.1021/jm020517g | ||
10552450 | 212090 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | 212090 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | ||
44461071 | 212417 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4s3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL81785 | 212417 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 425 | 8 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4s3)[C@@H]1C2 | 10.1021/jm0205189 | ||
11004079 | 212108 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 407 | 10 | 2 | 4 | 3.6 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm020517g | ||
CHEMBL79522 | 212108 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 407 | 10 | 2 | 4 | 3.6 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm020517g | ||
3356 | 9060 | 73 | None | 165 | 2 | Human | 8.4 | pIC50 | = | 8.4 | 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 | 9060 | 73 | None | 165 | 2 | Human | 8.4 | pIC50 | = | 8.4 | 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 | 9060 | 73 | None | 165 | 2 | Human | 8.4 | pIC50 | = | 8.4 | 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 | 9060 | 73 | None | 165 | 2 | Human | 8.4 | pIC50 | = | 8.4 | 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 | 9060 | 73 | None | 165 | 2 | Human | 8.4 | pIC50 | = | 8.4 | 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 | ||
10277744 | 71186 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813116 | 71186 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | ||
56665068 | 71598 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819622 | 71598 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
56665068 | 71598 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819622 | 71598 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
57396336 | 75010 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 481 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915857 | 75010 | 0 | None | - | 1 | Mouse | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 481 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
11409320 | 75009 | 0 | None | 1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915856 | 75009 | 0 | None | 1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
11582022 | 63765 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 396 | 8 | 2 | 7 | 3.8 | COc1ccc(CCNc2cc(-c3ccc(F)c(/C=N/O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644248 | 63765 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 396 | 8 | 2 | 7 | 3.8 | COc1ccc(CCNc2cc(-c3ccc(F)c(/C=N/O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
53494965 | 71587 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819611 | 71587 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.007 | ||
53494965 | 71587 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819611 | 71587 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
11202310 | 75003 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1c(C)cc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915675 | 75003 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1c(C)cc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
24765153 | 191308 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | 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 | ||
CHEMBL484778 | 191308 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | 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 | ||
53323152 | 63740 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 382 | 8 | 2 | 6 | 3.4 | COc1ccc(CCNc2cc(-c3ccc(F)c(CN)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644223 | 63740 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 382 | 8 | 2 | 6 | 3.4 | COc1ccc(CCNc2cc(-c3ccc(F)c(CN)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56658149 | 71601 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 496 | 8 | 2 | 6 | 4.5 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819625 | 71601 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 496 | 8 | 2 | 6 | 4.5 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
11639470 | 63766 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 378 | 8 | 1 | 6 | 3.9 | COc1ccc(CCNc2cc(-c3ccc(N(C)C)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644249 | 63766 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 378 | 8 | 1 | 6 | 3.9 | COc1ccc(CCNc2cc(-c3ccc(N(C)C)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
134157241 | 160525 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3981836 | 160525 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
44460702 | 212355 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 452 | 9 | 2 | 5 | 3.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)NS(C)(=O)=O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL81338 | 212355 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 452 | 9 | 2 | 5 | 3.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)NS(C)(=O)=O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
134153775 | 159039 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 540 | 11 | 1 | 7 | 4.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(OCc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3969111 | 159039 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 540 | 11 | 1 | 7 | 4.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(OCc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
56668353 | 71206 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813278 | 71206 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
134155457 | 157862 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccco4)c3)CC2)cc1 | nan | ||
CHEMBL3959030 | 157862 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccco4)c3)CC2)cc1 | nan | ||
10502610 | 170497 | 0 | None | -1 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | 170497 | 0 | None | -1 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | ||
134137430 | 149889 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 477 | 10 | 1 | 6 | 3.7 | COc1cccc(OC2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1CCC(=O)O | nan | ||
CHEMBL3895537 | 149889 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 477 | 10 | 1 | 6 | 3.7 | COc1cccc(OC2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)c1CCC(=O)O | nan | ||
56661510 | 71213 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.8 | Cc1cc(OCC2Oc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813285 | 71213 | 0 | None | - | 1 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 457 | 6 | 1 | 6 | 4.8 | Cc1cc(OCC2Oc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
57403305 | 75015 | 0 | None | -1 | 2 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(C(=O)Nc2cc(C(C)(C)C(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915862 | 75015 | 0 | None | -1 | 2 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(C(=O)Nc2cc(C(C)(C)C(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
11718798 | 63769 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 424 | 9 | 1 | 7 | 4.5 | COc1ccc(CCNc2cc(-c3ccc(CN4CCCC4)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644251 | 63769 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 424 | 9 | 1 | 7 | 4.5 | COc1ccc(CCNc2cc(-c3ccc(CN4CCCC4)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
134145205 | 157241 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3954204 | 157241 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
10874343 | 212039 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 469 | 10 | 2 | 4 | 5.7 | O=C(O)CCCCCC[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL78939 | 212039 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 469 | 10 | 2 | 4 | 5.7 | O=C(O)CCCCCC[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | ||
134142210 | 151996 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 452 | 7 | 1 | 5 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(CC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3912589 | 151996 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 452 | 7 | 1 | 5 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(CC(=O)O)c3)CC2)cc1 | nan | ||
134138030 | 154739 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 507 | 9 | 2 | 8 | 2.6 | COC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3933935 | 154739 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 507 | 9 | 2 | 8 | 2.6 | COC(=O)Nc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
11145780 | 111667 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2cc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3[nH]2)cc1 | 10.1021/jm020517g | ||
CHEMBL311199 | 111667 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2cc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3[nH]2)cc1 | 10.1021/jm020517g | ||
10623568 | 212107 | 0 | None | 2 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm020517g | ||
CHEMBL79511 | 212107 | 0 | None | 2 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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/jm020517g | ||
10623568 | 212107 | 0 | None | 2 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | 212107 | 0 | None | 2 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | 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 | ||
134154521 | 159468 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4cccnc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3972788 | 159468 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4cccnc4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
118134853 | 160232 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 448 | 8 | 1 | 6 | 2.8 | Cc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
CHEMBL3979423 | 160232 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 448 | 8 | 1 | 6 | 2.8 | Cc1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | ||
59232263 | 159805 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 484 | 8 | 1 | 6 | 3.8 | CC(C)Sc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3975700 | 159805 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 484 | 8 | 1 | 6 | 3.8 | CC(C)Sc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
11134066 | 178450 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL446628 | 178450 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
134147019 | 156792 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 464 | 7 | 1 | 5 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(/C=C/C(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3950341 | 156792 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 464 | 7 | 1 | 5 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(/C=C/C(=O)O)c3)CC2)cc1 | nan | ||
53325826 | 63726 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 448 | 7 | 2 | 8 | 3.3 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(N2CCCC(c3nn[nH]n3)C2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644210 | 63726 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 448 | 7 | 2 | 8 | 3.3 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(N2CCCC(c3nn[nH]n3)C2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
53321839 | 63749 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 377 | 8 | 1 | 6 | 4.0 | COc1ccc(CCNc2cc(-c3cccc(C(C)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644232 | 63749 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 377 | 8 | 1 | 6 | 4.0 | COc1ccc(CCNc2cc(-c3cccc(C(C)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11260449 | 75005 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915677 | 75005 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.08.065 | ||
53323184 | 63779 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 391 | 7 | 1 | 6 | 5.0 | COc1ccc(CCNc2cc(-c3cc4ccccc4s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644261 | 63779 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 391 | 7 | 1 | 6 | 5.0 | COc1ccc(CCNc2cc(-c3cc4ccccc4s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56658148 | 71596 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)c1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819620 | 71596 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)c1 | 10.1016/j.bmc.2011.08.007 | ||
56682058 | 71592 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(F)cc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819616 | 71592 | 0 | None | - | 1 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(F)cc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | ||
15458814 | 212735 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | 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/jm0205189 | ||
CHEMBL84413 | 212735 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | 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/jm0205189 | ||
10502508 | 20913 | 0 | None | 17 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | 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 | 20913 | 0 | None | 17 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | 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 | ||
11236846 | 75002 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1cc(C)c(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915674 | 75002 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 474 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1cc(C)c(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | ||
56668529 | 71600 | 0 | None | - | 1 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3ccc(F)c(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819624 | 71600 | 0 | None | - | 1 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3ccc(F)c(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
21974328 | 73044 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL184684 | 73044 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
21974448 | 73737 | 0 | None | 5 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
CHEMBL186735 | 73737 | 0 | None | 5 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | ||
44460703 | 212356 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 376 | 8 | 2 | 4 | 4.1 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cncs3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL81339 | 212356 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 376 | 8 | 2 | 4 | 4.1 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cncs3)[C@@H]1C2 | 10.1021/jm0205189 | ||
59232380 | 150778 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 543 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3902817 | 150778 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 543 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
134135625 | 151004 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 10 | 2 | 10 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
CHEMBL3904534 | 151004 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 10 | 2 | 10 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cn1 | nan | ||
134146364 | 155557 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 465 | 8 | 1 | 5 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CC=C(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3940642 | 155557 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 465 | 8 | 1 | 5 | 4.1 | CC(C)Oc1ccc(S(=O)(=O)N2CC=C(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10601359 | 111076 | 0 | None | 151 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
CHEMBL309987 | 111076 | 0 | None | 151 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | ||
11951 | 7281 | 41 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | ||
59232326 | 7281 | 41 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | ||
CHEMBL3545043 | 7281 | 41 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | ||
44344457 | 117290 | 0 | None | -11 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | 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 | 117290 | 0 | None | -11 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | 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 | ||
11059915 | 170562 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL420588 | 170562 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
11352417 | 75004 | 0 | None | - | 1 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c1C | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915676 | 75004 | 0 | None | - | 1 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c1C | 10.1016/j.bmc.2011.08.065 | ||
11501025 | 63753 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 341 | 7 | 1 | 8 | 2.5 | COc1ccc(CCNc2cc(-c3nnc(C)o3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644236 | 63753 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 341 | 7 | 1 | 8 | 2.5 | COc1ccc(CCNc2cc(-c3nnc(C)o3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
53319215 | 63737 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 409 | 9 | 2 | 7 | 3.3 | COc1ccc(C[C@H](Nc2cc(-c3cccc(OC)c3)nc(OC)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644220 | 63737 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 409 | 9 | 2 | 7 | 3.3 | COc1ccc(C[C@H](Nc2cc(-c3cccc(OC)c3)nc(OC)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
44461209 | 212121 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | ||
CHEMBL79612 | 212121 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | ||
10116114 | 132664 | 0 | None | -3 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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.2011.08.065 | ||
CHEMBL364841 | 132664 | 0 | None | -3 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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.2011.08.065 | ||
10553794 | 170417 | 0 | None | 14 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm020517g | ||
CHEMBL420398 | 170417 | 0 | None | 14 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm020517g | ||
10648014 | 212078 | 0 | None | 1 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | 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/jm020517g | ||
CHEMBL79260 | 212078 | 0 | None | 1 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | 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/jm020517g | ||
118134875 | 149328 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 532 | 9 | 1 | 9 | 3.3 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)s1 | nan | ||
CHEMBL3890925 | 149328 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 532 | 9 | 1 | 9 | 3.3 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)s1 | nan | ||
134135835 | 151065 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 513 | 8 | 1 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)n3)CC2)cc1 | nan | ||
CHEMBL3905074 | 151065 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 513 | 8 | 1 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)n3)CC2)cc1 | nan | ||
134141903 | 154046 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 573 | 11 | 2 | 8 | 3.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4cccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3928699 | 154046 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 573 | 11 | 2 | 8 | 3.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4cccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
56682059 | 71595 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819619 | 71595 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.007 | ||
56682059 | 71595 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819619 | 71595 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.065 | ||
53321838 | 63742 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 374 | 8 | 1 | 6 | 3.9 | COc1ccc(CCNc2cc(-c3cccc(CC#N)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644225 | 63742 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 374 | 8 | 1 | 6 | 3.9 | COc1ccc(CCNc2cc(-c3cccc(CC#N)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11495368 | 63750 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 416 | 8 | 1 | 7 | 4.8 | COc1ccc(CCNc2cc(-c3cccc(-c4cc(C)no4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644233 | 63750 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 416 | 8 | 1 | 7 | 4.8 | COc1ccc(CCNc2cc(-c3cccc(-c4cc(C)no4)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56658145 | 71589 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819613 | 71589 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | ||
56657974 | 71214 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 468 | 6 | 1 | 5 | 5.0 | Cc1cc(OCC2Cc3ccccc3N2C)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813286 | 71214 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 468 | 6 | 1 | 5 | 5.0 | Cc1cc(OCC2Cc3ccccc3N2C)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
53317912 | 63772 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 377 | 8 | 1 | 6 | 4.0 | COc1ccc(CCNc2cc(-c3ccc(C(C)=O)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644254 | 63772 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 377 | 8 | 1 | 6 | 4.0 | COc1ccc(CCNc2cc(-c3ccc(C(C)=O)cc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
57394587 | 75018 | 0 | None | -6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C2(C(=O)O)CC2)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915865 | 75018 | 0 | None | -6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 520 | 7 | 2 | 5 | 5.6 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C2(C(=O)O)CC2)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
10594576 | 17783 | 0 | None | 69 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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 | 17783 | 0 | None | 69 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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 | ||
11668164 | 63746 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 386 | 7 | 1 | 6 | 4.4 | COc1ccc(CCNc2cc(-c3cccc4cnccc34)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644229 | 63746 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 386 | 7 | 1 | 6 | 4.4 | COc1ccc(CCNc2cc(-c3cccc4cnccc34)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
134143246 | 152442 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 516 | 9 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4cccs4)c3)CC2)cc1 | nan | ||
CHEMBL3915956 | 152442 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 516 | 9 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4cccs4)c3)CC2)cc1 | nan | ||
134148587 | 155037 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccoc4)c3)CC2)cc1 | nan | ||
CHEMBL3936430 | 155037 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccoc4)c3)CC2)cc1 | nan | ||
11826761 | 112710 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 467 | 11 | 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(Cc2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL312834 | 112710 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 467 | 11 | 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(Cc2ccccc2)cc1 | 10.1021/jm020517g | ||
11597347 | 63760 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 439 | 11 | 1 | 8 | 4.2 | CCOc1nc(NCCc2ccc(OC)c(OC)c2)cc(-c2ccc(OC)c(OC)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644243 | 63760 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 439 | 11 | 1 | 8 | 4.2 | CCOc1nc(NCCc2ccc(OC)c(OC)c2)cc(-c2ccc(OC)c(OC)c2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
134145151 | 157587 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 452 | 8 | 1 | 6 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3956785 | 157587 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 452 | 8 | 1 | 6 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)cc(OCC(=O)O)c3)CC2)cc1 | nan | ||
56678560 | 71207 | 0 | None | - | 1 | Mouse | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 518 | 7 | 1 | 7 | 4.7 | COc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813279 | 71207 | 0 | None | - | 1 | Mouse | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 518 | 7 | 1 | 7 | 4.7 | COc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | ||
10601359 | 111076 | 0 | None | 151 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm970343g | ||
CHEMBL309987 | 111076 | 0 | None | 151 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm970343g | ||
59232282 | 151381 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)C(C)C2)cc1 | nan | ||
CHEMBL3907812 | 151381 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)C(C)C2)cc1 | nan | ||
56664921 | 71212 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813284 | 71212 | 0 | None | - | 1 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
57391065 | 75014 | 0 | None | 39 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 528 | 7 | 2 | 5 | 5.9 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(C)(C)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915861 | 75014 | 0 | None | 39 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 528 | 7 | 2 | 5 | 5.9 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(C(C)(C)C(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
53317886 | 63725 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 424 | 7 | 2 | 6 | 3.7 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(N2CCC(C(=O)O)CC2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644209 | 63725 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 424 | 7 | 2 | 6 | 3.7 | COc1nc(NCCc2ccc(Cl)cc2Cl)cc(N2CCC(C(=O)O)CC2)n1 | 10.1016/j.bmcl.2010.11.071 | ||
11516699 | 63770 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 392 | 7 | 2 | 7 | 3.3 | COc1ccc(CCNc2cc(-c3ccc4[nH]c(=O)oc4c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644252 | 63770 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 392 | 7 | 2 | 7 | 3.3 | COc1ccc(CCNc2cc(-c3ccc4[nH]c(=O)oc4c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11582363 | 63776 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 413 | 8 | 1 | 7 | 3.2 | COc1ccc(CCNc2cc(-c3cccc(S(C)(=O)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644258 | 63776 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 413 | 8 | 1 | 7 | 3.2 | COc1ccc(CCNc2cc(-c3cccc(S(C)(=O)=O)c3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
56672020 | 71599 | 0 | None | - | 1 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
CHEMBL1819623 | 71599 | 0 | None | - | 1 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | ||
56672020 | 71599 | 0 | None | - | 1 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1819623 | 71599 | 0 | None | - | 1 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | ||
11495480 | 63743 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 421 | 9 | 3 | 6 | 4.0 | CCNC(=O)Nc1cccc(-c2cc(NCCc3ccc(OC)cc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644226 | 63743 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 421 | 9 | 3 | 6 | 4.0 | CCNC(=O)Nc1cccc(-c2cc(NCCc3ccc(OC)cc3)nc(OC)n2)c1 | 10.1016/j.bmcl.2010.11.071 | ||
11409320 | 75009 | 0 | None | -1 | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915856 | 75009 | 0 | None | -1 | 2 | Mouse | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
11631233 | 63751 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 326 | 7 | 1 | 7 | 2.8 | COc1ccc(CCNc2cc(-c3cnco3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644234 | 63751 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 326 | 7 | 1 | 7 | 2.8 | COc1ccc(CCNc2cc(-c3cnco3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11408533 | 148105 | 0 | None | 2089 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 148105 | 0 | None | 2089 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 148105 | 0 | None | 2089 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 148105 | 0 | None | 2089 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | ||
11667189 | 63747 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1ccc(CCNc2cc(-c3ccncc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644230 | 63747 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 336 | 7 | 1 | 6 | 3.2 | COc1ccc(CCNc2cc(-c3ccncc3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
10671942 | 110993 | 0 | None | 16 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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/jm020517g | ||
CHEMBL309835 | 110993 | 0 | None | 16 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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/jm020517g | ||
10671942 | 110993 | 0 | None | 16 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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 | 110993 | 0 | None | 16 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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 | ||
134149036 | 155450 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 557 | 10 | 2 | 9 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccn(C)n4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3939753 | 155450 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 557 | 10 | 2 | 9 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccn(C)n4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
10767455 | 112587 | 0 | None | 16 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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/jm020517g | ||
CHEMBL312697 | 112587 | 0 | None | 16 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | 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/jm020517g | ||
56671851 | 71211 | 0 | None | - | 1 | Mouse | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
CHEMBL1813283 | 71211 | 0 | None | - | 1 | Mouse | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 455 | 6 | 1 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | ||
11826199 | 110994 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 9 | 2 | 3 | 4.9 | CC(C)(C)c1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm020517g | ||
CHEMBL309847 | 110994 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 9 | 2 | 3 | 4.9 | CC(C)(C)c1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm020517g | ||
44460682 | 212179 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 419 | 8 | 2 | 2 | 5.8 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4ccccc4c3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL80042 | 212179 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 419 | 8 | 2 | 2 | 5.8 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4ccccc4c3)[C@@H]1C2 | 10.1021/jm0205189 | ||
44461195 | 112264 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 465 | 9 | 2 | 3 | 6.7 | Cc1scc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1-c1ccccc1 | 10.1021/jm0205189 | ||
CHEMBL312092 | 112264 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 465 | 9 | 2 | 3 | 6.7 | Cc1scc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1-c1ccccc1 | 10.1021/jm0205189 | ||
59232270 | 156984 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2C)cc1 | nan | ||
CHEMBL3952004 | 156984 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2C)cc1 | nan | ||
44461047 | 212168 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 409 | 8 | 2 | 3 | 5.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4o3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL79998 | 212168 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 409 | 8 | 2 | 3 | 5.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4o3)[C@@H]1C2 | 10.1021/jm0205189 | ||
10648014 | 212078 | 0 | None | 1 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | 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 | 212078 | 0 | None | 1 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | 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 | ||
134135533 | 151061 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
CHEMBL3905053 | 151061 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | ||
54764763 | 75016 | 0 | None | -11 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C(C)(C)C(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
CHEMBL1915863 | 75016 | 0 | None | -11 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 522 | 7 | 2 | 5 | 5.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(C(C)(C)C(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | ||
53324508 | 63756 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 355 | 7 | 1 | 6 | 4.2 | COc1ccc(CCNc2cc(-c3ccc(C)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
CHEMBL1644239 | 63756 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 355 | 7 | 1 | 6 | 4.2 | COc1ccc(CCNc2cc(-c3ccc(C)s3)nc(OC)n2)cc1 | 10.1016/j.bmcl.2010.11.071 | ||
11294166 | 83820 | 0 | None | 10232 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 83820 | 0 | None | 10232 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 83820 | 0 | None | 10232 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 83820 | 0 | None | 10232 | 2 | Human | 8.1 | pIC50 | = | 8.1 | 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 | ||
59232298 | 153223 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 486 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1F | nan | ||
CHEMBL3922050 | 153223 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 486 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1F | nan | ||
11123892 | 110962 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 | 10.1021/jm020517g | ||
CHEMBL309752 | 110962 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 | 10.1021/jm020517g | ||
134146420 | 155959 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 558 | 10 | 2 | 9 | 3.0 | Cc1cc(C(=O)Nc2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)no1 | nan | ||
CHEMBL3943711 | 155959 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 558 | 10 | 2 | 9 | 3.0 | Cc1cc(C(=O)Nc2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)no1 | nan | ||
44460945 | 111521 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 399 | 8 | 2 | 5 | 4.0 | CC1(C)[C@H]2C[C@H](C/C=C/CCCc3nnn[nH]3)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
CHEMBL310673 | 111521 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 399 | 8 | 2 | 5 | 4.0 | CC1(C)[C@H]2C[C@H](C/C=C/CCCc3nnn[nH]3)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | ||
52948585 | 26040 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | 26040 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | ||
52943623 | 25752 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | 25752 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | ||
52944928 | 26064 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | 26064 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | 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 | ||
52941281 | 26039 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26039 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
11386109 | 26103 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26103 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
21019821 | 26007 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26007 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
52949846 | 26081 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26081 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
11294992 | 26123 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26123 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
52948543 | 26022 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | 26022 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
11488860 | 26063 | 0 | None | 7762 | 2 | Human | 9.4 | pKi | = | 9.4 | 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 | 26063 | 0 | None | 7762 | 2 | Human | 9.4 | pKi | = | 9.4 | 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 | ||
52944959 | 26082 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | 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 | 26082 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | 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 | ||
11259797 | 26006 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | 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 | 26006 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | 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 | 25992 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | 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 | 25992 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | 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 | ||
22225815 | 25862 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | CC(c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCCC2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1289084 | 25862 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | CC(c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCCC2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
22225815 | 25862 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | CC(c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCCC2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
CHEMBL1289084 | 25862 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 463 | 5 | 1 | 4 | 5.3 | CC(c1ccc(Cl)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCCC2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | ||
119461 | 7108 | 72 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10.1021/jm401431x | ||
1896 | 7108 | 72 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10.1021/jm401431x | ||
CHEMBL1317823 | 7108 | 72 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10.1021/jm401431x | ||
10483360 | 206007 | 28 | None | -19 | 4 | Human | 6.8 | pKi | = | 6.8 | Functional | 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 | 206007 | 28 | None | -19 | 4 | Human | 6.8 | pKi | = | 6.8 | Functional | 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 | ||
52945002 | 26102 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | 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 | 26102 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | 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 | ||
10402929 | 64317 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | 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 | 64317 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | 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 | ||
44377464 | 126863 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL350832 | 126863 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
9817292 | 64001 | 0 | None | - | 0 | Human | 5.4 | pKi | = | 5.4 | Functional | ChEMBL | 284 | 5 | 1 | 2 | 4.1 | CSc1ccc(Cc2ccccc2/C=C/C(=O)O)cc1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL165010 | 64001 | 0 | None | - | 0 | Human | 5.4 | pKi | = | 5.4 | Functional | ChEMBL | 284 | 5 | 1 | 2 | 4.1 | CSc1ccc(Cc2ccccc2/C=C/C(=O)O)cc1 | 10.1016/s0960-894x(01)00056-7 | ||
9817405 | 172182 | 5 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL423815 | 172182 | 5 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
5077 | 10351 | 79 | None | 5 | 13 | Human | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | None | ||
7552 | 10351 | 79 | None | 5 | 13 | Human | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | None | ||
9913767 | 10351 | 79 | None | 5 | 13 | Human | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | None | ||
CHEMBL238804 | 10351 | 79 | None | 5 | 13 | Human | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | None | ||
DB11362 | 10351 | 79 | None | 5 | 13 | Human | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 496 | 12 | 1 | 7 | 3.9 | O=C(NS(=O)(=O)C)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C | None | ||
138 | 9855 | 88 | None | -4 | 10 | Human | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 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 | 9855 | 88 | None | -4 | 10 | Human | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 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 | 9855 | 88 | None | -4 | 10 | Human | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 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 | 9855 | 88 | None | -4 | 10 | Human | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 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 | 9855 | 88 | None | -4 | 10 | Human | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 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 | ||
10169 | 10762 | 43 | None | -1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 24900313 | ||
42641863 | 10762 | 43 | None | -1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 24900313 | ||
CHEMBL1951575 | 10762 | 43 | None | -1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 24900313 | ||
DB12272 | 10762 | 43 | None | -1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 24900313 | ||
1987175 | 10566 | 31 | None | -123 | 5 | Human | 4.8 | pKB | = | 4.8 | Functional | Guide to Pharmacology | 491 | 7 | 3 | 7 | 3.6 | CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)F | 23914286 | ||
9283 | 10566 | 31 | None | -123 | 5 | Human | 4.8 | pKB | = | 4.8 | Functional | Guide to Pharmacology | 491 | 7 | 3 | 7 | 3.6 | CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)F | 23914286 | ||
CHEMBL1372836 | 10566 | 31 | None | -123 | 5 | Human | 4.8 | pKB | = | 4.8 | Functional | Guide to Pharmacology | 491 | 7 | 3 | 7 | 3.6 | CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)F | 23914286 | ||
10603 | 10564 | 0 | None | -741 | 3 | Human | 5.1 | pKB | = | 5.1 | Functional | Guide to Pharmacology | 400 | 6 | 3 | 5 | 4.0 | Cc1cc(Nc2ncc(cn2)C(=O)NCCc2c(C)[nH]c3c2cccc3)nc(c1)C | 31904232 | ||
145996528 | 10564 | 0 | None | -741 | 3 | Human | 5.1 | pKB | = | 5.1 | Functional | Guide to Pharmacology | 400 | 6 | 3 | 5 | 4.0 | Cc1cc(Nc2ncc(cn2)C(=O)NCCc2c(C)[nH]c3c2cccc3)nc(c1)C | 31904232 | ||
CHEMBL4552900 | 10564 | 0 | None | -741 | 3 | Human | 5.1 | pKB | = | 5.1 | Functional | Guide to Pharmacology | 400 | 6 | 3 | 5 | 4.0 | Cc1cc(Nc2ncc(cn2)C(=O)NCCc2c(C)[nH]c3c2cccc3)nc(c1)C | 31904232 |
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
118727294 | 124187 | 0 | None | - | 0 | Human | 8.8 | pEC50 | = | 8.8 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398215 | 124187 | 0 | None | - | 0 | Human | 8.8 | pEC50 | = | 8.8 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2015.01.024 | |||
118727299 | 124192 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 510 | 8 | 1 | 6 | 5.2 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398220 | 124192 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 510 | 8 | 1 | 6 | 5.2 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727287 | 124180 | 0 | None | - | 0 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398208 | 124180 | 0 | None | - | 0 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727301 | 124194 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 466 | 7 | 1 | 5 | 4.8 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3ccccc3)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398222 | 124194 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 466 | 7 | 1 | 5 | 4.8 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3ccccc3)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727285 | 124178 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 466 | 7 | 1 | 5 | 4.8 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3ccccc3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398206 | 124178 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 466 | 7 | 1 | 5 | 4.8 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3ccccc3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727316 | 124209 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 427 | 9 | 1 | 4 | 5.3 | O=C(O)COc1cccc2c1CCC=C2CCON=C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398237 | 124209 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 427 | 9 | 1 | 4 | 5.3 | O=C(O)COc1cccc2c1CCC=C2CCON=C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2015.01.024 | |||
118727300 | 124193 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398221 | 124193 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727288 | 124181 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 480 | 7 | 1 | 5 | 5.2 | Cc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398209 | 124181 | 0 | None | - | 0 | Human | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 480 | 7 | 1 | 5 | 5.2 | Cc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727298 | 124191 | 0 | None | - | 0 | Human | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)cc1F | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398219 | 124191 | 0 | None | - | 0 | Human | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)cc1F | 10.1016/j.bmcl.2015.01.024 | |||
118727297 | 124190 | 0 | None | - | 0 | Human | 7.5 | pEC50 | = | 7.5 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)c(F)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398218 | 124190 | 0 | None | - | 0 | Human | 7.5 | pEC50 | = | 7.5 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)c(F)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727306 | 124199 | 0 | None | - | 0 | Human | 7.5 | pEC50 | = | 7.5 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3ccccc3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398227 | 124199 | 0 | None | - | 0 | Human | 7.5 | pEC50 | = | 7.5 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3ccccc3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727307 | 124200 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 502 | 7 | 1 | 5 | 5.1 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398228 | 124200 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 502 | 7 | 1 | 5 | 5.1 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727308 | 124201 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cnn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)c2-c2ccccc2)c1F | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398229 | 124201 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cnn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)c2-c2ccccc2)c1F | 10.1016/j.bmcl.2015.01.024 | |||
118727314 | 124207 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398235 | 124207 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727289 | 124182 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3cccc(F)c3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398210 | 124182 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3cccc(F)c3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727302 | 124195 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1cccc(-c2cnn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)c2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398223 | 124195 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 496 | 8 | 1 | 6 | 4.9 | COc1cccc(-c2cnn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)c2-c2ccccc2)c1 | 10.1016/j.bmcl.2015.01.024 | |||
118727315 | 124208 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CC[C@@H](Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398236 | 124208 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 520 | 7 | 1 | 5 | 5.3 | O=C(O)COc1cccc2c1CC[C@@H](Cn1ncc(-c3cccc(F)c3F)c(-c3ccc(F)cc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727291 | 124184 | 0 | None | - | 0 | Human | 8.2 | pEC50 | = | 8.2 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1F | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398212 | 124184 | 0 | None | - | 0 | Human | 8.2 | pEC50 | = | 8.2 | Binding | ChEMBL | 514 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2cc(=O)n(CC3CCc4c(cccc4OCC(=O)O)C3)nc2-c2ccccc2)c1F | 10.1016/j.bmcl.2015.01.024 | |||
118727290 | 124183 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 500 | 7 | 1 | 5 | 5.5 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3cccc(Cl)c3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398211 | 124183 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 500 | 7 | 1 | 5 | 5.5 | O=C(O)COc1cccc2c1CCC(Cn1nc(-c3ccccc3)c(-c3cccc(Cl)c3)cc1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
118727303 | 124196 | 0 | None | - | 0 | Human | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
CHEMBL3398224 | 124196 | 0 | None | - | 0 | Human | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.0 | O=C(O)COc1cccc2c1CCC(Cn1ncc(-c3cccc(F)c3)c(-c3ccccc3)c1=O)C2 | 10.1016/j.bmcl.2015.01.024 | |||
10741899 | 17290 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | 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 | 17290 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | 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 | |||
9867949 | 17291 | 24 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | 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)c3csc4ccc(O)cc34)[C@@H]1C2 | 10.1021/jm970343g | |||
CHEMBL116837 | 17291 | 24 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | 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)c3csc4ccc(O)cc34)[C@@H]1C2 | 10.1021/jm970343g | |||
44461046 | 212159 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | 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/jm0205189 | |||
CHEMBL79943 | 212159 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | 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/jm0205189 | |||
10599289 | 20914 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | 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 | 20914 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | 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 | |||
3356 | 9060 | 73 | None | 38 | 8 | Human | 8.9 | pIC50 | = | 8.9 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.9 | pIC50 | = | 8.9 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.9 | pIC50 | = | 8.9 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.9 | pIC50 | = | 8.9 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.9 | pIC50 | = | 8.9 | 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 | |||
9803349 | 112185 | 2 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | 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/jm0205189 | |||
CHEMBL311790 | 112185 | 2 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | 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/jm0205189 | |||
57395246 | 77723 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 650 | 10 | 3 | 6 | 6.5 | O=C(O)Cc1cc(Cl)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951573 | 77723 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 650 | 10 | 3 | 6 | 6.5 | O=C(O)Cc1cc(Cl)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
57397843 | 77578 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 590 | 11 | 3 | 7 | 6.0 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950877 | 77578 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 590 | 11 | 3 | 7 | 6.0 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
57335620 | 77579 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)c[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950878 | 77579 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)c[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
10961839 | 212500 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL82537 | 212500 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)cc1 | 10.1021/jm020517g | |||
45268455 | 202916 | 48 | None | -147 | 4 | Human | 6.0 | pIC50 | = | 6 | 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.2009.06.085 | |||
CHEMBL561132 | 202916 | 48 | None | -147 | 4 | Human | 6.0 | pIC50 | = | 6 | 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.2009.06.085 | |||
11517351 | 206109 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 419 | 6 | 1 | 3 | 6.3 | O=C(O)Cc1sc(C(c2ccccc2)c2ccccc2)nc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.12.015 | |||
CHEMBL590582 | 206109 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 419 | 6 | 1 | 3 | 6.3 | O=C(O)Cc1sc(C(c2ccccc2)c2ccccc2)nc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.12.015 | |||
45486021 | 204196 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/ml1002234 | |||
CHEMBL569537 | 204196 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/ml1002234 | |||
45486030 | 204284 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 578 | 10 | 3 | 6 | 5.5 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570009 | 204284 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 578 | 10 | 3 | 6 | 5.5 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
90644208 | 118501 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 576 | 10 | 3 | 5 | 6.9 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(CC(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287083 | 118501 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 576 | 10 | 3 | 5 | 6.9 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(CC(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
57335620 | 77579 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)c[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950878 | 77579 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)c[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
25106870 | 118505 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 568 | 8 | 3 | 5 | 6.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C)c(Cl)c2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287087 | 118505 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 568 | 8 | 3 | 5 | 6.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C)c(Cl)c2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
11123892 | 110962 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL309752 | 110962 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 | 10.1021/jm020517g | |||
10553794 | 170417 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm970343g | |||
CHEMBL420398 | 170417 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm970343g | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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 | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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.2014.04.092 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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.2014.04.092 | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
56834988 | 76255 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 634 | 12 | 3 | 6 | 7.0 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CCCC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933762 | 76255 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 634 | 12 | 3 | 6 | 7.0 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CCCC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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.2011.10.123 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 7.9 | pIC50 | = | 7.9 | 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.2011.10.123 | |||
45486026 | 205587 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 522 | 9 | 3 | 5 | 5.0 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL583453 | 205587 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 522 | 9 | 3 | 5 | 5.0 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
57398777 | 77706 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1021/ml1002234 | |||
CHEMBL1951556 | 77706 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1021/ml1002234 | |||
68505312 | 97115 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 472 | 5 | 1 | 3 | 5.8 | CCc1ccc(-c2ccc(C(=O)N3CCc4c(c5cccc(Cl)c5n4CC(=O)O)C3)cc2)cc1 | 10.1021/jm400122f | |||
CHEMBL2385905 | 97115 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 472 | 5 | 1 | 3 | 5.8 | CCc1ccc(-c2ccc(C(=O)N3CCc4c(c5cccc(Cl)c5n4CC(=O)O)C3)cc2)cc1 | 10.1021/jm400122f | |||
10874343 | 212039 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 469 | 10 | 2 | 4 | 5.7 | O=C(O)CCCCCC[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL78939 | 212039 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 469 | 10 | 2 | 4 | 5.7 | O=C(O)CCCCCC[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
10502610 | 170497 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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 | 170497 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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 | |||
11059915 | 170562 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL420588 | 170562 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NS(=O)(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
145970031 | 171961 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 501 | 5 | 1 | 5 | 5.7 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC[C@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
CHEMBL4228478 | 171961 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 501 | 5 | 1 | 5 | 5.7 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CCC[C@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
56924869 | 75156 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | 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 | 75156 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | 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 | |||
10180 | 10364 | 58 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 3 | 1 | 3 | 4.2 | Fc1ccc2c(c1)c1CN(CCc1n2CC(=O)O)C(=O)c1cccc2c1cccc2 | 10.1021/jm400122f | |||
49843471 | 10364 | 58 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 3 | 1 | 3 | 4.2 | Fc1ccc2c(c1)c1CN(CCc1n2CC(=O)O)C(=O)c1cccc2c1cccc2 | 10.1021/jm400122f | |||
CHEMBL2386081 | 10364 | 58 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 3 | 1 | 3 | 4.2 | Fc1ccc2c(c1)c1CN(CCc1n2CC(=O)O)C(=O)c1cccc2c1cccc2 | 10.1021/jm400122f | |||
DB12562 | 10364 | 58 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 3 | 1 | 3 | 4.2 | Fc1ccc2c(c1)c1CN(CCc1n2CC(=O)O)C(=O)c1cccc2c1cccc2 | 10.1021/jm400122f | |||
145969532 | 171894 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | 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.2018.01.039 | |||
CHEMBL4227417 | 171894 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | 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.2018.01.039 | |||
10098978 | 76259 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 12 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
CHEMBL1933766 | 76259 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 12 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
57400456 | 77720 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 612 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl | 10.1021/ml1002234 | |||
CHEMBL1951570 | 77720 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 612 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl | 10.1021/ml1002234 | |||
10098978 | 76259 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 12 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933766 | 76259 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 12 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2011.10.123 | |||
44460814 | 212342 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | |||
CHEMBL81231 | 212342 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | |||
90644206 | 118503 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 562 | 10 | 3 | 5 | 6.7 | CCCc1cc2c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c(Oc3ccc(CC(=O)O)cc3OC)ccc2[nH]1 | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287085 | 118503 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 562 | 10 | 3 | 5 | 6.7 | CCCc1cc2c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c(Oc3ccc(CC(=O)O)cc3OC)ccc2[nH]1 | 10.1016/j.bmcl.2014.04.092 | |||
67242411 | 118506 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 545 | 8 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C#N)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287088 | 118506 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 545 | 8 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C#N)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
10671942 | 110993 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | 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/jm020517g | |||
CHEMBL309835 | 110993 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | 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/jm020517g | |||
10671942 | 110993 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | 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 | 110993 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | 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 | |||
90479860 | 118507 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 536 | 8 | 3 | 6 | 4.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(c1NS(=O)(=O)c1ccc(Cl)cc1Cl)CC(=O)N2 | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287089 | 118507 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 536 | 8 | 3 | 6 | 4.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(c1NS(=O)(=O)c1ccc(Cl)cc1Cl)CC(=O)N2 | 10.1016/j.bmcl.2014.04.092 | |||
10529683 | 170423 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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 | 170423 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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 | |||
11123691 | 112413 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@@H]1C[C@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)[C@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
CHEMBL312441 | 112413 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@@H]1C[C@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)[C@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
11134618 | 112416 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@@H]1C[C@@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)[C@@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
CHEMBL312476 | 112416 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 481 | 10 | 2 | 3 | 5.9 | CC1(C)[C@H]2C[C@@H]1C[C@@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)[C@@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
10529683 | 170423 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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/jm0205189 | |||
CHEMBL420404 | 170423 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | 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/jm0205189 | |||
45486053 | 204390 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 546 | 9 | 3 | 7 | 4.4 | CCNC(=O)c1ccc(Oc2ccc(Cc3nnn[nH]3)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570669 | 204390 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 546 | 9 | 3 | 7 | 4.4 | CCNC(=O)c1ccc(Oc2ccc(Cc3nnn[nH]3)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
57393532 | 77713 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 584 | 11 | 3 | 5 | 6.4 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951563 | 77713 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 584 | 11 | 3 | 5 | 6.4 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57403988 | 77717 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 5.8 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951567 | 77717 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 5.8 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
44128594 | 77724 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 652 | 9 | 3 | 6 | 6.8 | CC(C)(C)NC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951574 | 77724 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 652 | 9 | 3 | 6 | 6.8 | CC(C)(C)NC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
57393533 | 77719 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 584 | 8 | 3 | 5 | 6.4 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951569 | 77719 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 584 | 8 | 3 | 5 | 6.4 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57401263 | 77576 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 576 | 10 | 3 | 7 | 5.6 | CCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950875 | 77576 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 576 | 10 | 3 | 7 | 5.6 | CCc1nc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
11145780 | 111667 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 522 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2cc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3[nH]2)cc1 | 10.1021/jm020517g | |||
CHEMBL311199 | 111667 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 522 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2cc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3[nH]2)cc1 | 10.1021/jm020517g | |||
57403006 | 77570 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 11 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc3c(c2)OCC3CC(=O)O)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950869 | 77570 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 11 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc3c(c2)OCC3CC(=O)O)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
44461194 | 212651 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 429 | 8 | 2 | 3 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4c3CCCC4)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL83788 | 212651 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 429 | 8 | 2 | 3 | 5.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4c3CCCC4)[C@@H]1C2 | 10.1021/jm0205189 | |||
11165749 | 172738 | 0 | None | 10 | 3 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL425167 | 172738 | 0 | None | 10 | 3 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
57404015 | 77702 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 548 | 9 | 3 | 5 | 5.5 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951402 | 77702 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 548 | 9 | 3 | 5 | 5.5 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 | 10.1021/ml1002234 | |||
10547489 | 170113 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | 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 | 170113 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | 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 | |||
11395329 | 130625 | 0 | None | 17 | 2 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL362541 | 130625 | 0 | None | 17 | 2 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44460942 | 212162 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | 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/jm0205189 | |||
CHEMBL79972 | 212162 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | 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/jm0205189 | |||
57505249 | 116952 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.7 | Cc1c(-c2cn(C(C)C)c(=O)c3ccccc23)c2cc(F)ccc2n1CC(=O)O | 10.1021/jm401509e | |||
CHEMBL3236948 | 116952 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.7 | Cc1c(-c2cn(C(C)C)c(=O)c3ccccc23)c2cc(F)ccc2n1CC(=O)O | 10.1021/jm401509e | |||
9985715 | 204385 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 582 | 11 | 3 | 7 | 5.0 | CCNC(=O)c1ccc(Oc2c(OC)cc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570653 | 204385 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 582 | 11 | 3 | 7 | 5.0 | CCNC(=O)c1ccc(Oc2c(OC)cc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
9985715 | 204385 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 582 | 11 | 3 | 7 | 5.0 | CCNC(=O)c1ccc(Oc2c(OC)cc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL570653 | 204385 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 582 | 11 | 3 | 7 | 5.0 | CCNC(=O)c1ccc(Oc2c(OC)cc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
66967770 | 171932 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | 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.2018.01.039 | |||
CHEMBL4227971 | 171932 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | 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.2018.01.039 | |||
90479860 | 118507 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 536 | 8 | 3 | 6 | 4.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(c1NS(=O)(=O)c1ccc(Cl)cc1Cl)CC(=O)N2 | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287089 | 118507 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 536 | 8 | 3 | 6 | 4.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(c1NS(=O)(=O)c1ccc(Cl)cc1Cl)CC(=O)N2 | 10.1016/j.bmcl.2014.04.092 | |||
45486038 | 205764 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCCC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL585385 | 205764 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCCC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
10896473 | 212032 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 508 | 10 | 4 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccc(O)cc3)[nH]c2c1 | 10.1021/jm020517g | |||
CHEMBL78904 | 212032 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 508 | 10 | 4 | 4 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2cc(-c3ccc(O)cc3)[nH]c2c1 | 10.1021/jm020517g | |||
10951130 | 111652 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC(C)(CC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(=O)O | 10.1021/jm020517g | |||
CHEMBL311105 | 111652 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 495 | 9 | 2 | 4 | 6.1 | CC(C)(CC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(=O)O | 10.1021/jm020517g | |||
44460962 | 112206 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1sccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
CHEMBL311977 | 112206 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 389 | 8 | 2 | 3 | 5.0 | Cc1sccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
57395246 | 77723 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 650 | 10 | 3 | 6 | 6.5 | O=C(O)Cc1cc(Cl)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951573 | 77723 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 650 | 10 | 3 | 6 | 6.5 | O=C(O)Cc1cc(Cl)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
44461071 | 212417 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | 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)c3cc4ccccc4s3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL81785 | 212417 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | 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)c3cc4ccccc4s3)[C@@H]1C2 | 10.1021/jm0205189 | |||
57395244 | 77711 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 614 | 12 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951561 | 77711 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 614 | 12 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
11123848 | 111183 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | 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)c1ccc(-c2cc3ccccc3[nH]2)cc1 | 10.1021/jm020517g | |||
CHEMBL310301 | 111183 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | 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)c1ccc(-c2cc3ccccc3[nH]2)cc1 | 10.1021/jm020517g | |||
10939814 | 212061 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1cc2oc3ccccc3c2cc1O | 10.1021/jm020517g | |||
CHEMBL79095 | 212061 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1cc2oc3ccccc3c2cc1O | 10.1021/jm020517g | |||
52920263 | 90382 | 8 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 3.6 | Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(=O)O | 10.1021/jm300007n | |||
CHEMBL2204469 | 90382 | 8 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 3.6 | Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(=O)O | 10.1021/jm300007n | |||
45486099 | 204221 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OCC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569719 | 204221 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OCC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
69561043 | 171831 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
CHEMBL4226404 | 171831 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
44460939 | 212737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | 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/jm0205189 | |||
CHEMBL84452 | 212737 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | 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/jm0205189 | |||
57400457 | 77722 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 634 | 10 | 3 | 6 | 6.0 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951572 | 77722 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 634 | 10 | 3 | 6 | 6.0 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
10961840 | 86328 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C\c2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL2114171 | 86328 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 479 | 11 | 2 | 3 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C\c2ccccc2)cc1 | 10.1021/jm020517g | |||
10885356 | 111426 | 1 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccc(O)cc3c2c1 | 10.1021/jm020517g | |||
CHEMBL310505 | 111426 | 1 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 483 | 9 | 3 | 5 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccc(O)cc3c2c1 | 10.1021/jm020517g | |||
45486059 | 204238 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCNC(=O)c1ccc(Oc2ccc(CCC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569762 | 204238 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCNC(=O)c1ccc(Oc2ccc(CCC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
57398777 | 77706 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1021/ml1002234 | |||
CHEMBL1951556 | 77706 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 | 10.1021/ml1002234 | |||
57395244 | 77711 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 614 | 12 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951561 | 77711 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 614 | 12 | 3 | 6 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
57402257 | 77718 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 582 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951568 | 77718 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 582 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
56834989 | 76256 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 616 | 12 | 3 | 6 | 6.3 | CCCCNC(=O)c1ccc(Oc2ccc(C(F)(F)C(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933763 | 76256 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 616 | 12 | 3 | 6 | 6.3 | CCCCNC(=O)c1ccc(Oc2ccc(C(F)(F)C(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
44460691 | 212158 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 413 | 8 | 2 | 4 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4c(c3)OCO4)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL79941 | 212158 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 413 | 8 | 2 | 4 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc4c(c3)OCO4)[C@@H]1C2 | 10.1021/jm0205189 | |||
57402258 | 77721 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 618 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951571 | 77721 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 618 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
11081118 | 112600 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 466 | 9 | 3 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2[nH]c3ccccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL312715 | 112600 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 466 | 9 | 3 | 3 | 5.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2[nH]c3ccccc3c2c1 | 10.1021/jm020517g | |||
11762410 | 212129 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | 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)c1ccc2c(c1)oc1ccccc12 | 10.1021/jm020517g | |||
CHEMBL79669 | 212129 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | 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)c1ccc2c(c1)oc1ccccc12 | 10.1021/jm020517g | |||
57403988 | 77717 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 5.8 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951567 | 77717 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 568 | 9 | 3 | 5 | 5.8 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
45269307 | 203312 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 418 | 5 | 1 | 4 | 2.8 | CN([C@@H]1CCC2=C(C1)C1C=CC=CC1N2CC(=O)O)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL563664 | 203312 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 418 | 5 | 1 | 4 | 2.8 | CN([C@@H]1CCC2=C(C1)C1C=CC=CC1N2CC(=O)O)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
71733909 | 97109 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 452 | 3 | 1 | 3 | 5.1 | O=C(O)Cn1c2c(c3cc(C(F)(F)F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
CHEMBL2385899 | 97109 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 452 | 3 | 1 | 3 | 5.1 | O=C(O)Cn1c2c(c3cc(C(F)(F)F)ccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
57392568 | 77577 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 577 | 10 | 2 | 8 | 5.8 | CCc1noc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950876 | 77577 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 577 | 10 | 2 | 8 | 5.8 | CCc1noc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n1 | 10.1016/j.bmcl.2011.12.107 | |||
57391800 | 77712 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951562 | 77712 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57393533 | 77719 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 584 | 8 | 3 | 5 | 6.4 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951569 | 77719 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 584 | 8 | 3 | 5 | 6.4 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57396043 | 77567 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 11 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)nc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950866 | 77567 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 11 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)nc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
57400454 | 77709 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951559 | 77709 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 | 10.1021/ml1002234 | |||
10601359 | 111076 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
CHEMBL309987 | 111076 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
10696132 | 174903 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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/jm020517g | |||
CHEMBL432935 | 174903 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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/jm020517g | |||
11234840 | 131833 | 0 | None | 4 | 2 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1cccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)c1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL364421 | 131833 | 0 | None | 4 | 2 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1cccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)c1 | 10.1016/j.bmcl.2004.06.006 | |||
45270144 | 202130 | 33 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | 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 | 202130 | 33 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | 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 | |||
10502508 | 20913 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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 | 20913 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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 | |||
15458814 | 212735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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/jm0205189 | |||
CHEMBL84413 | 212735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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/jm0205189 | |||
50901658 | 67038 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 488 | 11 | 1 | 5 | 5.2 | CCOc1ccc(-c2ccc(-c3cc(CC(=O)O)ccc3OC)c(CN(CC)C(=O)C3CC3)c2)cn1 | 10.1016/j.bmcl.2010.12.016 | |||
CHEMBL1668898 | 67038 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 488 | 11 | 1 | 5 | 5.2 | CCOc1ccc(-c2ccc(-c3cc(CC(=O)O)ccc3OC)c(CN(CC)C(=O)C3CC3)c2)cn1 | 10.1016/j.bmcl.2010.12.016 | |||
CHEMBL1741107 | 67038 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 488 | 11 | 1 | 5 | 5.2 | CCOc1ccc(-c2ccc(-c3cc(CC(=O)O)ccc3OC)c(CN(CC)C(=O)C3CC3)c2)cn1 | 10.1016/j.bmcl.2010.12.016 | |||
25106871 | 118504 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(cc(C)n2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287086 | 118504 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(cc(C)n2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
10601359 | 111076 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm970343g | |||
CHEMBL309987 | 111076 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm970343g | |||
10696132 | 174903 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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 | 174903 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | 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 | |||
68508048 | 97108 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 3 | 1 | 3 | 4.4 | Cc1ccc2c(c1)c1c(n2CC(=O)O)CCN(C(=O)c2cccc3ccccc23)C1 | 10.1021/jm400122f | |||
CHEMBL2385898 | 97108 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 3 | 1 | 3 | 4.4 | Cc1ccc2c(c1)c1c(n2CC(=O)O)CCN(C(=O)c2cccc3ccccc23)C1 | 10.1021/jm400122f | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | 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.2011.10.123 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | 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.2011.10.123 | |||
10483360 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | 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.2011.12.107 | |||
CHEMBL589973 | 206007 | 28 | None | -147 | 4 | Human | 6.6 | pIC50 | = | 6.6 | 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.2011.12.107 | |||
57396044 | 77569 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc3c(ccn3CC(=O)O)c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950868 | 77569 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc3c(ccn3CC(=O)O)c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
11314979 | 72883 | 0 | None | 11 | 4 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 379 | 7 | 1 | 4 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(C)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL183933 | 72883 | 0 | None | 11 | 4 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 379 | 7 | 1 | 4 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(C)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
56834989 | 76256 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 616 | 12 | 3 | 6 | 6.3 | CCCCNC(=O)c1ccc(Oc2ccc(C(F)(F)C(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933763 | 76256 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 616 | 12 | 3 | 6 | 6.3 | CCCCNC(=O)c1ccc(Oc2ccc(C(F)(F)C(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
57400455 | 77714 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 5.9 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951564 | 77714 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 5.9 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
11187675 | 71988 | 0 | None | 61 | 4 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL182572 | 71988 | 0 | None | 61 | 4 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
10694649 | 20339 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 445 | 10 | 2 | 4 | 6.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NC(=O)c1ccc(/N=N/c2ccccc2)cc1 | 10.1021/jm970343g | |||
CHEMBL119397 | 20339 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 445 | 10 | 2 | 4 | 6.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NC(=O)c1ccc(/N=N/c2ccccc2)cc1 | 10.1021/jm970343g | |||
49800498 | 173793 | 15 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 9 | 1 | 5 | 6.0 | CCOc1cc(CN2CCC3(CC2)CC(=O)N(c2ccc(C(=O)O)cc2)C3)cc(OCC)c1-c1ccc(F)cc1 | 10.1021/acsmedchemlett.8b00305 | |||
CHEMBL4282052 | 173793 | 15 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 9 | 1 | 5 | 6.0 | CCOc1cc(CN2CCC3(CC2)CC(=O)N(c2ccc(C(=O)O)cc2)C3)cc(OCC)c1-c1ccc(F)cc1 | 10.1021/acsmedchemlett.8b00305 | |||
CHEMBL4288391 | 173793 | 15 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 546 | 9 | 1 | 5 | 6.0 | CCOc1cc(CN2CCC3(CC2)CC(=O)N(c2ccc(C(=O)O)cc2)C3)cc(OCC)c1-c1ccc(F)cc1 | 10.1021/acsmedchemlett.8b00305 | |||
45486074 | 204323 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570235 | 204323 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 566 | 11 | 3 | 6 | 5.4 | CCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
57395245 | 77715 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 575 | 11 | 3 | 6 | 5.6 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C#N)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951565 | 77715 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 575 | 11 | 3 | 6 | 5.6 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C#N)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
71733910 | 97110 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 3 | 1 | 3 | 4.9 | O=C(O)Cn1c2c(c3cc(F)cc(Cl)c31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
CHEMBL2385900 | 97110 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 3 | 1 | 3 | 4.9 | O=C(O)Cn1c2c(c3cc(F)cc(Cl)c31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
15486805 | 172832 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | 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 | 172832 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | 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 | |||
45268456 | 203484 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(c3ccccn3c2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL564845 | 203484 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(c3ccccn3c2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
44205724 | 75144 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 75144 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | 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 | |||
10864153 | 212339 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 11 | 2 | 5 | 5.9 | CCOc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
CHEMBL81185 | 212339 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 11 | 2 | 5 | 5.9 | CCOc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
10594576 | 17783 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | 17783 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | |||
10813802 | 20561 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | 20561 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | |||
10025456 | 120772 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | 120772 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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 | |||
44461053 | 212134 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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/jm0205189 | |||
CHEMBL79700 | 212134 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | 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/jm0205189 | |||
10874325 | 212591 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 468 | 11 | 3 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Nc2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL83269 | 212591 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 468 | 11 | 3 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(Nc2ccccc2)cc1 | 10.1021/jm020517g | |||
44460705 | 212379 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 370 | 8 | 2 | 3 | 4.1 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cccnc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL81538 | 212379 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 370 | 8 | 2 | 3 | 4.1 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cccnc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
44460692 | 170866 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | 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)c3cccs3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL420953 | 170866 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | 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)c3cccs3)[C@@H]1C2 | 10.1021/jm0205189 | |||
123879 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | 10060 | 82 | None | -43 | 4 | Human | 4.5 | pIC50 | = | 4.5 | 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 | |||
11071097 | 174588 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1ccc2oc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3c2c1 | 10.1021/jm020517g | |||
CHEMBL430627 | 174588 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 497 | 10 | 2 | 5 | 5.5 | COc1ccc2oc3ccc(S(=O)(=O)N[C@@H]4[C@@H]5CC[C@@H](C5)[C@H]4C/C=C\CCCC(=O)O)cc3c2c1 | 10.1021/jm020517g | |||
44460740 | 112209 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 385 | 8 | 3 | 3 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc(O)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL311999 | 112209 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 385 | 8 | 3 | 3 | 4.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc(O)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
10169 | 10762 | 43 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
42641863 | 10762 | 43 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
CHEMBL1951575 | 10762 | 43 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
DB12272 | 10762 | 43 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
59864915 | 118500 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 560 | 9 | 3 | 5 | 6.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C3CC3)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287082 | 118500 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 560 | 9 | 3 | 5 | 6.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C3CC3)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
45486065 | 204241 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 566 | 10 | 3 | 6 | 5.4 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC(C)C)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569772 | 204241 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 566 | 10 | 3 | 6 | 5.4 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC(C)C)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
45486054 | 204391 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 540 | 9 | 3 | 5 | 5.1 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570670 | 204391 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 540 | 9 | 3 | 5 | 5.1 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
11038515 | 212488 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 510 | 10 | 2 | 5 | 5.5 | CN(C)c1ccc2c(c1)oc1ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc12 | 10.1021/jm020517g | |||
CHEMBL82426 | 212488 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 510 | 10 | 2 | 5 | 5.5 | CN(C)c1ccc2c(c1)oc1ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc12 | 10.1021/jm020517g | |||
11091552 | 212099 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@@H]1C[C@@H](NC(=O)c1ccc(-c3ccccc3)cc1)[C@@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
CHEMBL79424 | 212099 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@@H]1C[C@@H](NC(=O)c1ccc(-c3ccccc3)cc1)[C@@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
57403987 | 77707 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951557 | 77707 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 | 10.1021/ml1002234 | |||
44159411 | 75163 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | 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 | 75163 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | 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 | |||
45272704 | 202470 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 418 | 5 | 1 | 6 | 1.8 | CN([C@@H]1CCc2c(c3nccnc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL556849 | 202470 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 418 | 5 | 1 | 6 | 1.8 | CN([C@@H]1CCc2c(c3nccnc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
145968972 | 171707 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
CHEMBL4224708 | 171707 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 5 | 1 | 5 | 5.3 | CS(=O)(=O)c1cc(F)cc2c1c(Sc1ccc(C(F)(F)F)cc1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2018.01.039 | |||
44128594 | 77724 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 652 | 9 | 3 | 6 | 6.8 | CC(C)(C)NC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951574 | 77724 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 652 | 9 | 3 | 6 | 6.8 | CC(C)(C)NC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1 | 10.1021/ml1002234 | |||
11005693 | 212089 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 506 | 10 | 2 | 4 | 5.7 | Cn1c(-c2ccccc2)cc2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc21 | 10.1021/jm020517g | |||
CHEMBL79320 | 212089 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 506 | 10 | 2 | 4 | 5.7 | Cn1c(-c2ccccc2)cc2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc21 | 10.1021/jm020517g | |||
11187675 | 71988 | 0 | None | 61 | 4 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL182572 | 71988 | 0 | None | 61 | 4 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44460415 | 111184 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cc1 | 10.1021/jm0205189 | |||
CHEMBL310304 | 111184 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cc1 | 10.1021/jm0205189 | |||
10169 | 10762 | 43 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
42641863 | 10762 | 43 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
CHEMBL1951575 | 10762 | 43 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
DB12272 | 10762 | 43 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 608 | 9 | 3 | 5 | 6.8 | OC(=O)Cc1cc(Cl)c(cc1F)Oc1ccc(cc1NS(=O)(=O)c1ccc(cc1Cl)C1CC1)C(=O)NC(C)(C)C | 10.1021/ml1002234 | |||
57335749 | 77580 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1cc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950879 | 77580 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1cc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
90644207 | 118499 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 534 | 8 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(ccn2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287081 | 118499 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 534 | 8 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(ccn2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
44159530 | 75159 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | 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 | 75159 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | 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 | |||
44159772 | 75167 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | 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 | 75167 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | 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 | |||
11406401 | 129889 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 381 | 7 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL361098 | 129889 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 381 | 7 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
45486021 | 204196 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569537 | 204196 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
45486021 | 204196 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/ml1002234 | |||
CHEMBL569537 | 204196 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 564 | 10 | 3 | 6 | 5.1 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/ml1002234 | |||
11059671 | 111645 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 465 | 10 | 2 | 5 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2cccs2)s1 | 10.1021/jm020517g | |||
CHEMBL311038 | 111645 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 465 | 10 | 2 | 5 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2cccs2)s1 | 10.1021/jm020517g | |||
71733818 | 97133 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 420 | 3 | 1 | 3 | 4.4 | O=C(O)Cn1c2c(c3cc(F)cc(Cl)c31)CN(C(=O)c1cccc(Cl)c1)CC2 | 10.1021/jm400122f | |||
CHEMBL2386078 | 97133 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 420 | 3 | 1 | 3 | 4.4 | O=C(O)Cn1c2c(c3cc(F)cc(Cl)c31)CN(C(=O)c1cccc(Cl)c1)CC2 | 10.1021/jm400122f | |||
45273637 | 202504 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 2.4 | CN([C@@H]1CCc2c(CC(=O)O)c3ncccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL557117 | 202504 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 2.4 | CN([C@@H]1CCc2c(CC(=O)O)c3ncccc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
57400457 | 77722 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 634 | 10 | 3 | 6 | 6.0 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951572 | 77722 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 634 | 10 | 3 | 6 | 6.0 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
10962613 | 110915 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 4.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL309443 | 110915 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 4.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
44460832 | 170869 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 451 | 9 | 2 | 3 | 6.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc(-c4ccccc4)c3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL420956 | 170869 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 451 | 9 | 2 | 3 | 6.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc(-c4ccccc4)c3)[C@@H]1C2 | 10.1021/jm0205189 | |||
44460730 | 111549 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 372 | 8 | 2 | 3 | 4.0 | Cn1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1 | 10.1021/jm0205189 | |||
CHEMBL310830 | 111549 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 372 | 8 | 2 | 3 | 4.0 | Cn1ccc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1 | 10.1021/jm0205189 | |||
45486025 | 204283 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 536 | 9 | 3 | 5 | 5.5 | CCNC(=O)c1ccc(Oc2ccc(C(C)C(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570005 | 204283 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 536 | 9 | 3 | 5 | 5.5 | CCNC(=O)c1ccc(Oc2ccc(C(C)C(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
57400455 | 77714 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 5.9 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951564 | 77714 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 568 | 11 | 3 | 5 | 5.9 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
45272700 | 203490 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccn3c2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL564920 | 203490 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccn3c2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
44460813 | 212394 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 9 | 2 | 4 | 4.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL81654 | 212394 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 9 | 2 | 4 | 4.6 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
90644206 | 118503 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 562 | 10 | 3 | 5 | 6.7 | CCCc1cc2c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c(Oc3ccc(CC(=O)O)cc3OC)ccc2[nH]1 | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287085 | 118503 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 562 | 10 | 3 | 5 | 6.7 | CCCc1cc2c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c(Oc3ccc(CC(=O)O)cc3OC)ccc2[nH]1 | 10.1016/j.bmcl.2014.04.092 | |||
57400456 | 77720 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 612 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl | 10.1021/ml1002234 | |||
CHEMBL1951570 | 77720 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 612 | 10 | 3 | 6 | 5.9 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl | 10.1021/ml1002234 | |||
57391799 | 77705 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 550 | 8 | 3 | 5 | 5.7 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
CHEMBL1951555 | 77705 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 550 | 8 | 3 | 5 | 5.7 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
10928987 | 170734 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 483 | 11 | 2 | 4 | 5.3 | COc1ccc(-c2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc2)cc1 | 10.1021/jm020517g | |||
CHEMBL420777 | 170734 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 483 | 11 | 2 | 4 | 5.3 | COc1ccc(-c2ccc(S(=O)(=O)N[C@@H]3[C@@H]4CC[C@@H](C4)[C@H]3C/C=C\CCCC(=O)O)cc2)cc1 | 10.1021/jm020517g | |||
1884 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm990542v | |||
5280363 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm990542v | |||
912 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm990542v | |||
CHEMBL815 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm990542v | |||
DB12789 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm990542v | |||
1884 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm010264b | |||
5280363 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm010264b | |||
912 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm010264b | |||
CHEMBL815 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm010264b | |||
DB12789 | 9857 | 52 | None | -213 | 22 | Human | 5.4 | pIC50 | = | 5.4 | Binding | 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 | 10.1021/jm010264b | |||
11282034 | 73404 | 0 | None | 10 | 3 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 437 | 11 | 1 | 5 | 5.6 | CCCCOc1ccc(C(=O)n2c(C)c(CCCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL185277 | 73404 | 0 | None | 10 | 3 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 437 | 11 | 1 | 5 | 5.6 | CCCCOc1ccc(C(=O)n2c(C)c(CCCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44460960 | 212170 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cscc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
CHEMBL80002 | 212170 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cscc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
57391799 | 77705 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 550 | 8 | 3 | 5 | 5.7 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
CHEMBL1951555 | 77705 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 550 | 8 | 3 | 5 | 5.7 | CC(C)(C)NC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 | 10.1021/ml1002234 | |||
57335749 | 77580 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1cc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950879 | 77580 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 589 | 11 | 3 | 6 | 6.6 | CCCc1cc(-c2ccc(Oc3ccc(CC(=O)O)cc3OC)c(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)n[nH]1 | 10.1016/j.bmcl.2011.12.107 | |||
56834988 | 76255 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 634 | 12 | 3 | 6 | 7.0 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CCCC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933762 | 76255 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 634 | 12 | 3 | 6 | 7.0 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CCCC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
44344457 | 117290 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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 | 117290 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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 | |||
44460460 | 212321 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
CHEMBL81004 | 212321 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 399 | 9 | 2 | 3 | 4.7 | COc1ccccc1C(=O)N[C@@H]1[C@@H](C/C=C/CCCC(=O)O)C[C@H]2C[C@@H]1C2(C)C | 10.1021/jm0205189 | |||
10767455 | 112587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | 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/jm020517g | |||
CHEMBL312697 | 112587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | 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/jm020517g | |||
10767455 | 112587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | 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 | 112587 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | 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 | |||
11134066 | 178450 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL446628 | 178450 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@H](C/C=C\CCCC(=O)O)[C@@H](NC(=O)c3ccc(-c4ccccc4)cc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
57396042 | 77566 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 551 | 11 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cn2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950865 | 77566 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 551 | 11 | 3 | 6 | 5.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cn2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
10717385 | 175291 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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 | 175291 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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 | |||
57390758 | 77571 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 3 | 6 | 6.5 | CCCCNC(=O)c1ccc(Oc2ccc3c(CC(=O)O)coc3c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950870 | 77571 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 3 | 6 | 6.5 | CCCCNC(=O)c1ccc(Oc2ccc3c(CC(=O)O)coc3c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
57403987 | 77707 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951557 | 77707 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 | 10.1021/ml1002234 | |||
11037643 | 212094 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@@H]1C[C@H](NC(=O)c1ccc(-c3ccccc3)cc1)[C@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
CHEMBL79370 | 212094 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 445 | 9 | 2 | 2 | 6.3 | CC1(C)[C@H]2C[C@@H]1C[C@H](NC(=O)c1ccc(-c3ccccc3)cc1)[C@H]2C/C=C\CCCC(=O)O | 10.1021/jm0205189 | |||
57400454 | 77709 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951559 | 77709 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 | 10.1021/ml1002234 | |||
44461024 | 113880 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 408 | 8 | 3 | 2 | 5.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3c[nH]c4ccccc34)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL315977 | 113880 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 408 | 8 | 3 | 2 | 5.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3c[nH]c4ccccc34)[C@@H]1C2 | 10.1021/jm0205189 | |||
44461209 | 212121 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | |||
CHEMBL79612 | 212121 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 405 | 9 | 2 | 4 | 4.7 | COc1cc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)cs1 | 10.1021/jm0205189 | |||
51031012 | 77031 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 482 | 12 | 1 | 5 | 5.3 | O=C(O)CCCOc1cccc(CCCn2nc(C(c3ccccc3)c3ccccc3)ccc2=O)c1 | 10.1016/j.bmcl.2011.11.079 | |||
CHEMBL1941127 | 77031 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 482 | 12 | 1 | 5 | 5.3 | O=C(O)CCCOc1cccc(CCCn2nc(C(c3ccccc3)c3ccccc3)ccc2=O)c1 | 10.1016/j.bmcl.2011.11.079 | |||
11826761 | 112710 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 467 | 11 | 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(Cc2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL312834 | 112710 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 467 | 11 | 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(Cc2ccccc2)cc1 | 10.1021/jm020517g | |||
10595288 | 212097 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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 | 212097 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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 | |||
10595288 | 212097 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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/jm0205189 | |||
CHEMBL79413 | 212097 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | 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/jm0205189 | |||
11091707 | 212327 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 455 | 9 | 2 | 3 | 4.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccccc1Br | 10.1021/jm020517g | |||
CHEMBL81050 | 212327 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 455 | 9 | 2 | 3 | 4.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccccc1Br | 10.1021/jm020517g | |||
10552450 | 212090 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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 | 212090 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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 | |||
10552450 | 212090 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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/jm0205189 | |||
CHEMBL79360 | 212090 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | 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/jm0205189 | |||
11811847 | 212410 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 419 | 9 | 2 | 3 | 4.5 | Cc1cc(C)c(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)c(C)c1 | 10.1021/jm020517g | |||
CHEMBL81751 | 212410 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 419 | 9 | 2 | 3 | 4.5 | Cc1cc(C)c(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)c(C)c1 | 10.1021/jm020517g | |||
10917396 | 212419 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 452 | 11 | 2 | 6 | 3.5 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1[N+](=O)[O-] | 10.1021/jm020517g | |||
CHEMBL81804 | 212419 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 452 | 11 | 2 | 6 | 3.5 | COc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CC[C@@H](C3)[C@H]2C/C=C\CCCC(=O)O)cc1[N+](=O)[O-] | 10.1021/jm020517g | |||
9872340 | 204099 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 552 | 10 | 3 | 6 | 5.0 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL568819 | 204099 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 552 | 10 | 3 | 6 | 5.0 | CCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
11733560 | 111514 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 481 | 12 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(CCc2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL310643 | 111514 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 481 | 12 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(CCc2ccccc2)cc1 | 10.1021/jm020517g | |||
10553794 | 170417 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL420398 | 170417 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 512 | 10 | 2 | 6 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 | 10.1021/jm020517g | |||
44460923 | 212491 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 9 | 2 | 3 | 4.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)Cc3ccoc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL82468 | 212491 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 9 | 2 | 3 | 4.2 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)Cc3ccoc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
10951507 | 111118 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 525 | 10 | 2 | 5 | 6.1 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCC(C)(C)C(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
CHEMBL309999 | 111118 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 525 | 10 | 2 | 5 | 6.1 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1C/C=C\CCC(C)(C)C(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
57398523 | 76269 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 577 | 10 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1CS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933913 | 76269 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 577 | 10 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NC2CCC2)cc1CS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2011.10.123 | |||
11026912 | 111336 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 459 | 10 | 2 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)s1 | 10.1021/jm020517g | |||
CHEMBL310454 | 111336 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 459 | 10 | 2 | 4 | 5.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)s1 | 10.1021/jm020517g | |||
45486100 | 204226 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 580 | 11 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NCC(C)C)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569727 | 204226 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 580 | 11 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)NCC(C)C)cc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.09.052 | |||
44461195 | 112264 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 9 | 2 | 3 | 6.7 | Cc1scc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1-c1ccccc1 | 10.1021/jm0205189 | |||
CHEMBL312092 | 112264 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 465 | 9 | 2 | 3 | 6.7 | Cc1scc(C(=O)N[C@@H]2[C@@H](C/C=C/CCCC(=O)O)C[C@H]3C[C@@H]2C3(C)C)c1-c1ccccc1 | 10.1021/jm0205189 | |||
16222207 | 14417 | 0 | None | - | 0 | Mouse | 5.2 | pIC50 | = | 5.2 | 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 | 14417 | 0 | None | - | 0 | Mouse | 5.2 | pIC50 | = | 5.2 | 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 | |||
57391800 | 77712 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 564 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951562 | 77712 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 564 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2C)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57401983 | 76258 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 657 | 13 | 3 | 8 | 4.7 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)NS(C)(=O)=O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933765 | 76258 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 657 | 13 | 3 | 8 | 4.7 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)NS(C)(=O)=O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
57392564 | 77572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 578 | 12 | 3 | 5 | 5.6 | CCCCNC(=O)c1ccc(Cc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950871 | 77572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 578 | 12 | 3 | 5 | 5.6 | CCCCNC(=O)c1ccc(Cc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
57398778 | 77716 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 586 | 11 | 3 | 5 | 6.0 | CCCCNC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951566 | 77716 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 586 | 11 | 3 | 5 | 6.0 | CCCCNC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
10623568 | 212107 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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/jm020517g | |||
CHEMBL79511 | 212107 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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/jm020517g | |||
10623568 | 212107 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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 | 212107 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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 | |||
11005555 | 212415 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL81768 | 212415 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 496 | 11 | 3 | 4 | 4.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 | 10.1021/jm020517g | |||
44460702 | 212355 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 452 | 9 | 2 | 5 | 3.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)NS(C)(=O)=O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL81338 | 212355 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 452 | 9 | 2 | 5 | 3.7 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)NS(C)(=O)=O)[C@@H](NC(=O)c3ccsc3)[C@@H]1C2 | 10.1021/jm0205189 | |||
90644208 | 118501 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 576 | 10 | 3 | 5 | 6.9 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(CC(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287083 | 118501 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 576 | 10 | 3 | 5 | 6.9 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(CC(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
11103335 | 168489 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 521 | 11 | 2 | 7 | 4.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2nnnn2-c2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL413523 | 168489 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 521 | 11 | 2 | 7 | 4.2 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2nnnn2-c2ccccc2)cc1 | 10.1021/jm020517g | |||
57392565 | 77573 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 566 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Sc2ccc(CC(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950872 | 77573 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 566 | 11 | 3 | 5 | 6.1 | CCCCNC(=O)c1ccc(Sc2ccc(CC(=O)O)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
11070932 | 112738 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 483 | 9 | 2 | 4 | 5.9 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2sc3ccccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL312983 | 112738 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 483 | 9 | 2 | 4 | 5.9 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2sc3ccccc3c2c1 | 10.1021/jm020517g | |||
11135113 | 112181 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 521 | 10 | 2 | 3 | 6.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 | 10.1021/jm020517g | |||
CHEMBL311769 | 112181 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 521 | 10 | 2 | 3 | 6.3 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 | 10.1021/jm020517g | |||
11134192 | 212671 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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)c1cccc(-c2ccccc2)c1 | 10.1021/jm020517g | |||
CHEMBL83893 | 212671 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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)c1cccc(-c2ccccc2)c1 | 10.1021/jm020517g | |||
11812883 | 112303 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 483 | 10 | 2 | 5 | 4.9 | O=C(O)CCCCC(=O)C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
CHEMBL312182 | 112303 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 483 | 10 | 2 | 5 | 4.9 | O=C(O)CCCCC(=O)C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc2oc3ccccc3c2c1 | 10.1021/jm020517g | |||
10648014 | 212078 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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/jm020517g | |||
CHEMBL79260 | 212078 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | 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/jm020517g | |||
68505327 | 97135 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 418 | 3 | 1 | 3 | 4.7 | O=C(O)Cn1c2c(c3cc(Cl)ccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
CHEMBL2386080 | 97135 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 418 | 3 | 1 | 3 | 4.7 | O=C(O)Cn1c2c(c3cc(Cl)ccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
44461047 | 212168 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 409 | 8 | 2 | 3 | 5.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4o3)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL79998 | 212168 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 409 | 8 | 2 | 3 | 5.4 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3cc4ccccc4o3)[C@@H]1C2 | 10.1021/jm0205189 | |||
57398778 | 77716 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 586 | 11 | 3 | 5 | 6.0 | CCCCNC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951566 | 77716 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 586 | 11 | 3 | 5 | 6.0 | CCCCNC(=O)c1ccc(Oc2cc(F)c(CC(=O)O)cc2F)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
57396746 | 76257 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 604 | 12 | 3 | 8 | 5.2 | CCCCNC(=O)c1ccc(Oc2ccc(Cc3nnn[nH]3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933764 | 76257 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 604 | 12 | 3 | 8 | 5.2 | CCCCNC(=O)c1ccc(Oc2ccc(Cc3nnn[nH]3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
10648014 | 212078 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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 | 212078 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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 | |||
11462174 | 10592 | 90 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 4.3 | Fc1ccc2c(c1)c(Cc1ccc3c(n1)cccc3)c(n2CC(=O)O)C | 10.1016/j.bmcl.2009.06.085 | |||
9277 | 10592 | 90 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 4.3 | Fc1ccc2c(c1)c(Cc1ccc3c(n1)cccc3)c(n2CC(=O)O)C | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL560993 | 10592 | 90 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 4.3 | Fc1ccc2c(c1)c(Cc1ccc3c(n1)cccc3)c(n2CC(=O)O)C | 10.1016/j.bmcl.2009.06.085 | |||
DB11900 | 10592 | 90 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 348 | 4 | 1 | 3 | 4.3 | Fc1ccc2c(c1)c(Cc1ccc3c(n1)cccc3)c(n2CC(=O)O)C | 10.1016/j.bmcl.2009.06.085 | |||
59864915 | 118500 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 560 | 9 | 3 | 5 | 6.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C3CC3)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287082 | 118500 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 560 | 9 | 3 | 5 | 6.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C3CC3)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
44460938 | 112361 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 518 | 10 | 3 | 5 | 5.3 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(NS(C)(=O)=O)cc34)[C@@H]1C2 | 10.1021/jm0205189 | |||
CHEMBL312216 | 112361 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 518 | 10 | 3 | 5 | 5.3 | CC1(C)[C@H]2C[C@H](C/C=C/CCCC(=O)O)[C@@H](NC(=O)c3csc4ccc(NS(C)(=O)=O)cc34)[C@@H]1C2 | 10.1021/jm0205189 | |||
25106871 | 118504 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(cc(C)n2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287086 | 118504 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(cc(C)n2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
11539410 | 97114 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.2 | CCc1ccc(-c2ccc(C(=O)N3CCc4c(c5ccccc5n4CC(=O)O)C3)cc2)cc1 | 10.1021/jm400122f | |||
CHEMBL2385904 | 97114 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 438 | 5 | 1 | 3 | 5.2 | CCc1ccc(-c2ccc(C(=O)N3CCc4c(c5ccccc5n4CC(=O)O)C3)cc2)cc1 | 10.1021/jm400122f | |||
11653874 | 97134 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 384 | 3 | 1 | 3 | 4.1 | O=C(O)Cn1c2c(c3ccccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
CHEMBL2386079 | 97134 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 384 | 3 | 1 | 3 | 4.1 | O=C(O)Cn1c2c(c3ccccc31)CN(C(=O)c1cccc3ccccc13)CC2 | 10.1021/jm400122f | |||
10529261 | 212551 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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 | 212551 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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 | |||
10529261 | 212551 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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/jm0205189 | |||
CHEMBL82896 | 212551 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | 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/jm0205189 | |||
57393532 | 77713 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 584 | 11 | 3 | 5 | 6.4 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951563 | 77713 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 584 | 11 | 3 | 5 | 6.4 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1021/ml1002234 | |||
10552612 | 212495 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | 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/jm020517g | |||
CHEMBL82489 | 212495 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | 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/jm020517g | |||
10552612 | 212495 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | 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 | 212495 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | 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 | |||
67242411 | 118506 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 545 | 8 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C#N)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287088 | 118506 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 545 | 8 | 3 | 6 | 5.6 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C#N)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
11509269 | 97499 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 385 | 4 | 1 | 4 | 3.6 | N#C/C(=C\c1cn(CC(=O)O)c2ccccc12)C(=O)N1CCCc2ccccc21 | 10.1016/j.bmcl.2012.12.050 | |||
CHEMBL2391518 | 97499 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 385 | 4 | 1 | 4 | 3.6 | N#C/C(=C\c1cn(CC(=O)O)c2ccccc12)C(=O)N1CCCc2ccccc21 | 10.1016/j.bmcl.2012.12.050 | |||
57390757 | 77568 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 11 | 4 | 5 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc3c(CC(=O)O)c[nH]c3c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
CHEMBL1950867 | 77568 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 11 | 4 | 5 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc3c(CC(=O)O)c[nH]c3c2)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.12.107 | |||
45486043 | 204318 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 570 | 9 | 3 | 5 | 5.9 | CCNC(=O)c1ccc(Oc2cc(Cl)cc(CC(=O)O)c2)c(NS(=O)(=O)c2cc(C)c(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL570204 | 204318 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 570 | 9 | 3 | 5 | 5.9 | CCNC(=O)c1ccc(Oc2cc(Cl)cc(CC(=O)O)c2)c(NS(=O)(=O)c2cc(C)c(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
90644209 | 118502 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 576 | 8 | 3 | 5 | 7.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C(C)(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287084 | 118502 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 576 | 8 | 3 | 5 | 7.0 | COc1cc(CC(=O)O)ccc1Oc1ccc2[nH]c(C(C)(C)C)cc2c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
44190762 | 183659 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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 | 183659 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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 | |||
57404015 | 77702 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 9 | 3 | 5 | 5.5 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951402 | 77702 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 9 | 3 | 5 | 5.5 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 | 10.1021/ml1002234 | |||
16222207 | 14417 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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 | 14417 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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 | |||
11037976 | 212412 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 467 | 11 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)Cc1ccc(-c2ccccc2)cc1 | 10.1021/jm020517g | |||
CHEMBL81757 | 212412 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 467 | 11 | 2 | 3 | 5.4 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)Cc1ccc(-c2ccccc2)cc1 | 10.1021/jm020517g | |||
11102462 | 212617 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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)c1ccccc1-c1ccccc1 | 10.1021/jm020517g | |||
CHEMBL83485 | 212617 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | 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)c1ccccc1-c1ccccc1 | 10.1021/jm020517g | |||
45486009 | 204191 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 594 | 13 | 3 | 6 | 6.1 | CCCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
CHEMBL569521 | 204191 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 594 | 13 | 3 | 6 | 6.1 | CCCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2009.09.052 | |||
90644207 | 118499 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 534 | 8 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(ccn2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
CHEMBL3287081 | 118499 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 534 | 8 | 2 | 6 | 5.7 | COc1cc(CC(=O)O)ccc1Oc1ccc2c(ccn2C)c1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2014.04.092 | |||
57402257 | 77718 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 582 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
CHEMBL1951568 | 77718 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 582 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1ccc(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(Cl)cc2Cl)c(Cl)c1 | 10.1021/ml1002234 | |||
57402258 | 77721 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 618 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
CHEMBL1951571 | 77721 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 618 | 9 | 3 | 5 | 6.1 | O=C(O)Cc1cc(F)c(Oc2ccc(C(=O)NC3CCC3)cc2NS(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)cc1F | 10.1021/ml1002234 | |||
10885393 | 212386 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 11 | 2 | 4 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)s1 | 10.1021/jm020517g | |||
CHEMBL81600 | 212386 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 11 | 2 | 4 | 5.8 | O=C(O)CCC/C=C\C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(/C=C/c2ccccc2)s1 | 10.1021/jm020517g | |||
45270148 | 202197 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 2.4 | CN([C@@H]1CCc2c(c3cccnc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
CHEMBL552211 | 202197 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 2.4 | CN([C@@H]1CCc2c(c3cccnc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2009.06.085 | |||
57396745 | 76254 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 606 | 12 | 3 | 6 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
CHEMBL1933761 | 76254 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 606 | 12 | 3 | 6 | 6.2 | CCCCNC(=O)c1ccc(Oc2ccc(C3(C(=O)O)CC3)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2011.10.123 | |||
11418818 | 73436 | 0 | None | 7 | 4 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 423 | 10 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(C)c(CCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL185369 | 73436 | 0 | None | 7 | 4 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 423 | 10 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(C)c(CCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
57400453 | 77708 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1 | 10.1021/ml1002234 | |||
CHEMBL1951558 | 77708 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 580 | 12 | 3 | 6 | 5.8 | CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1 | 10.1021/ml1002234 | |||
10874929 | 112597 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 513 | 11 | 2 | 6 | 4.9 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1CC(=O)CCCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
CHEMBL312707 | 112597 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 513 | 11 | 2 | 6 | 4.9 | COc1cc2c(cc1S(=O)(=O)N[C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1CC(=O)CCCCC(=O)O)oc1ccccc12 | 10.1021/jm020517g | |||
3356 | 9060 | 73 | None | 38 | 8 | Human | 10.5 | pKd | = | 10.5 | 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 | 9060 | 73 | None | 38 | 8 | Human | 10.5 | pKd | = | 10.5 | 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 | 9060 | 73 | None | 38 | 8 | Human | 10.5 | pKd | = | 10.5 | 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 | 9060 | 73 | None | 38 | 8 | Human | 10.5 | pKd | = | 10.5 | 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 | 9060 | 73 | None | 38 | 8 | Human | 10.5 | pKd | = | 10.5 | 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 | |||
44138108 | 191064 | 0 | None | 2630 | 6 | Human | 9.5 | pKi | = | 9.5 | 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 | 191064 | 0 | None | 2630 | 6 | Human | 9.5 | pKi | = | 9.5 | 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 | |||
10433093 | 191309 | 0 | None | 1000 | 2 | Human | 9.4 | pKi | = | 9.4 | 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 | 191309 | 0 | None | 1000 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44591563 | 198687 | 0 | None | 478 | 2 | Human | 9.4 | pKi | = | 9.4 | 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 | 198687 | 0 | None | 478 | 2 | Human | 9.4 | pKi | = | 9.4 | 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 | |||
11743676 | 190968 | 0 | None | 3981 | 2 | Human | 9.3 | pKi | = | 9.3 | 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 | 190968 | 0 | None | 3981 | 2 | Human | 9.3 | pKi | = | 9.3 | 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 | |||
3356 | 9060 | 73 | None | 38 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | 9060 | 73 | None | 38 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | 9060 | 73 | None | 38 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | 9060 | 73 | None | 38 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | 9060 | 73 | None | 38 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | |||
10216733 | 91011 | 49 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm800219f | |||
CHEMBL221007 | 91011 | 49 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm800219f | |||
24765153 | 191308 | 0 | None | 363 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | 191308 | 0 | None | 363 | 8 | Human | 9.2 | pKi | = | 9.2 | 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 | |||
44591562 | 191307 | 0 | None | 9120 | 2 | Human | 9.2 | pKi | = | 9.2 | 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 | 191307 | 0 | None | 9120 | 2 | Human | 9.2 | pKi | = | 9.2 | 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 | |||
11741746 | 190992 | 0 | None | 3981 | 2 | Human | 9.2 | pKi | = | 9.2 | 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 | 190992 | 0 | None | 3981 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 400 | 5 | 1 | 4 | 5.9 | CC(C)c1nccc2c1c(Sc1ccc(Cl)cc1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44591535 | 190967 | 0 | None | 4677 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | 190967 | 0 | None | 4677 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | |||
44591515 | 190909 | 0 | None | 524 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | 190909 | 0 | None | 524 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | |||
44591457 | 195847 | 0 | None | 8 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | 195847 | 0 | None | 8 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 414 | 5 | 1 | 4 | 6.3 | CC(C)c1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44591537 | 198007 | 0 | None | 537 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | 198007 | 0 | None | 537 | 2 | Human | 9.1 | pKi | = | 9.1 | 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 | |||
44591513 | 190876 | 0 | None | 1862 | 2 | Human | 9.0 | pKi | = | 9.0 | 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 | 190876 | 0 | None | 1862 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 420 | 5 | 1 | 4 | 6.0 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44411555 | 83819 | 0 | None | 177 | 2 | Human | 9.0 | pKi | = | 9 | 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 | 83819 | 0 | None | 177 | 2 | Human | 9.0 | pKi | = | 9 | 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 | |||
14372504 | 145064 | 0 | None | 2 | 2 | Human | 9.0 | pKi | = | 9 | 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 | 145064 | 0 | None | 2 | 2 | Human | 9.0 | pKi | = | 9 | 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 | |||
44591516 | 190965 | 0 | None | 588 | 2 | Human | 9.0 | pKi | = | 9 | 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 | 190965 | 0 | None | 588 | 2 | Human | 9.0 | pKi | = | 9 | 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 | |||
44591477 | 196411 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 7.1 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(-c3ccccc3)nccc12 | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL514964 | 196411 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 7.1 | O=C(O)CC1CCn2c1c(Sc1ccc(Cl)c(Cl)c1)c1c(-c3ccccc3)nccc12 | 10.1016/j.bmcl.2009.03.010 | |||
44591512 | 199329 | 0 | None | 691 | 2 | Human | 9.0 | pKi | = | 9 | 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 | 199329 | 0 | None | 691 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.4 | CCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
11269563 | 148388 | 0 | None | 12 | 5 | Human | 9.0 | pKi | = | 9.0 | 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 | 148388 | 0 | None | 12 | 5 | Human | 9.0 | pKi | = | 9.0 | 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 | |||
16681720 | 197643 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm800219f | |||
CHEMBL518461 | 197643 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 399 | 5 | 1 | 3 | 5.2 | CC(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm800219f | |||
44591536 | 198006 | 0 | None | 549 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | 198006 | 0 | None | 549 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 448 | 6 | 1 | 4 | 6.8 | CCCc1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44591561 | 191132 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1c(Cl)cccc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL484404 | 191132 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1c(Cl)cccc1Cl)c1n2CCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
10028338 | 186599 | 0 | None | 776 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | 186599 | 0 | None | 776 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | |||
10254794 | 198996 | 0 | None | 17 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | 198996 | 0 | None | 17 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | |||
10344683 | 195641 | 0 | None | 4897 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | 195641 | 0 | None | 4897 | 2 | Human | 8.9 | pKi | = | 8.9 | 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 | |||
11597294 | 172955 | 4 | None | -1 | 8 | Human | 8.8 | pKi | = | 8.8 | 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 | 172955 | 4 | None | -1 | 8 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
44591762 | 198598 | 0 | None | 26 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 5 | 1 | 6 | 5.1 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc3ccccc13)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL519862 | 198598 | 0 | None | 26 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 466 | 5 | 1 | 6 | 5.1 | CS(=O)(=O)c1ccnc2c1c(Sc1cccc3ccccc13)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
18476686 | 83301 | 0 | None | 117 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | 83301 | 0 | None | 117 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
16049493 | 85045 | 0 | None | 75 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | 85045 | 0 | None | 75 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
15157541 | 103913 | 0 | None | 5 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | 103913 | 0 | None | 5 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
11315933 | 130072 | 4 | None | 218 | 5 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 413 | 7 | 1 | 4 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL361457 | 130072 | 4 | None | 218 | 5 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 413 | 7 | 1 | 4 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
11294166 | 83820 | 0 | None | 213 | 3 | Human | 8.7 | pKi | = | 8.7 | 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 | 83820 | 0 | None | 213 | 3 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
9801972 | 84913 | 0 | None | 25 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | 84913 | 0 | None | 25 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
11294166 | 83820 | 0 | None | 213 | 3 | Human | 8.7 | pKi | = | 8.7 | 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 | 83820 | 0 | None | 213 | 3 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
10074101 | 190874 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | 190874 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
44411688 | 84955 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | 84955 | 0 | None | 2 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
10480515 | 191112 | 0 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | 191112 | 0 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
44394380 | 132207 | 0 | None | 1 | 4 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL364593 | 132207 | 0 | None | 1 | 4 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
10361472 | 71982 | 0 | None | 199 | 3 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)cc3c(CC(=O)O)cccc32)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL182555 | 71982 | 0 | None | 199 | 3 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)cc3c(CC(=O)O)cccc32)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
21974448 | 73737 | 0 | None | 28 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL186735 | 73737 | 0 | None | 28 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
44394380 | 132207 | 0 | None | -1 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL364593 | 132207 | 0 | None | -1 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
10116114 | 132664 | 0 | None | -3 | 8 | Mouse | 8.0 | pKi | = | 8 | 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.bmcl.2004.07.039 | |||
CHEMBL364841 | 132664 | 0 | None | -3 | 8 | Mouse | 8.0 | pKi | = | 8 | 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.bmcl.2004.07.039 | |||
11187675 | 71988 | 0 | None | 61 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL182572 | 71988 | 0 | None | 61 | 4 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
53317958 | 63586 | 0 | None | -95 | 3 | Human | 7.0 | pKi | = | 7.0 | 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 | 63586 | 0 | None | -95 | 3 | Human | 7.0 | pKi | = | 7.0 | 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 | |||
44591806 | 190933 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 402 | 5 | 1 | 5 | 5.2 | COc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL482953 | 190933 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 402 | 5 | 1 | 5 | 5.2 | COc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
53325910 | 63606 | 0 | None | -51 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1cccc(F)c1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643793 | 63606 | 0 | None | -51 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1cccc(F)c1 | 10.1016/j.bmcl.2010.11.015 | |||
53325908 | 63596 | 0 | None | -676 | 3 | Human | 6.0 | pKi | = | 6.0 | 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 | 63596 | 0 | None | -676 | 3 | Human | 6.0 | pKi | = | 6.0 | 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 | |||
14372497 | 84081 | 0 | None | -6 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | 84081 | 0 | None | -6 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | |||
56658145 | 71589 | 0 | None | - | 1 | Mouse | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819613 | 71589 | 0 | None | - | 1 | Mouse | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
11187675 | 71988 | 0 | None | 61 | 4 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL182572 | 71988 | 0 | None | 61 | 4 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 365 | 7 | 1 | 4 | 4.4 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44411567 | 145621 | 0 | None | -1 | 2 | Human | 7.0 | pKi | = | 7.0 | 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 | 145621 | 0 | None | -1 | 2 | Human | 7.0 | pKi | = | 7.0 | 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 | |||
22083975 | 145175 | 0 | None | 2 | 2 | Human | 6.0 | pKi | = | 6.0 | 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 | 145175 | 0 | None | 2 | 2 | Human | 6.0 | pKi | = | 6.0 | 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 | |||
134152908 | 160109 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 515 | 9 | 1 | 8 | 3.4 | Cc1cnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | |||
CHEMBL3978260 | 160109 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 515 | 9 | 1 | 8 | 3.4 | Cc1cnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | |||
134141903 | 154046 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 573 | 11 | 2 | 8 | 3.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4cccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3928699 | 154046 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 573 | 11 | 2 | 8 | 3.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4cccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
123879 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | 10060 | 82 | None | -43 | 4 | Human | 5.0 | pKi | = | 5.0 | 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 | |||
25817650 | 69968 | 1 | None | -1202 | 3 | Human | 6.0 | pKi | = | 6.0 | 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 | 69968 | 1 | None | -1202 | 3 | Human | 6.0 | pKi | = | 6.0 | 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 | |||
56658148 | 71596 | 0 | None | - | 1 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819620 | 71596 | 0 | None | - | 1 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)c1 | 10.1016/j.bmc.2011.08.007 | |||
10432190 | 190875 | 0 | None | 6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 418 | 5 | 1 | 5 | 5.9 | CSc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL482548 | 190875 | 0 | None | 6 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 418 | 5 | 1 | 5 | 5.9 | CSc1ccnc2c1c(Sc1ccc(Cl)cc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
44394432 | 134104 | 0 | None | 1 | 5 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL365908 | 134104 | 0 | None | 1 | 5 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
46213069 | 9837 | 0 | None | -1905 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 456 | 7 | 1 | 5 | 4.2 | COc1ccc(cc1)C(=O)N1CCC(C1)(COc1ccc(cc1)c1ccc(cc1)C#N)C(=O)O | 10.1021/acs.jmedchem.1c00816 | |||
8538 | 9837 | 0 | None | -1905 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 456 | 7 | 1 | 5 | 4.2 | COc1ccc(cc1)C(=O)N1CCC(C1)(COc1ccc(cc1)c1ccc(cc1)C#N)C(=O)O | 10.1021/acs.jmedchem.1c00816 | |||
CHEMBL5285583 | 9837 | 0 | None | -1905 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 456 | 7 | 1 | 5 | 4.2 | COc1ccc(cc1)C(=O)N1CCC(C1)(COc1ccc(cc1)c1ccc(cc1)C#N)C(=O)O | 10.1021/acs.jmedchem.1c00816 | |||
15948325 | 9304 | 45 | None | -977 | 6 | Human | 5.9 | pKi | = | 5.9 | 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 | 9304 | 45 | None | -977 | 6 | Human | 5.9 | pKi | = | 5.9 | 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 | 9304 | 45 | None | -977 | 6 | Human | 5.9 | pKi | = | 5.9 | 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 | |||
25817650 | 69968 | 1 | None | -1202 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | |||
CHEMBL179036 | 69968 | 1 | None | -1202 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(c3ccccc3n2CC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1 | 10.1021/jm049036i | |||
24765766 | 13518 | 0 | None | -30 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 446 | 6 | 2 | 3 | 5.8 | Cc1cn(Cc2cccc(Cl)c2)c2c(C(=O)N[C@@H](C)c3ccc(C(=O)O)cc3)cccc12 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1083746 | 13518 | 0 | None | -30 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 446 | 6 | 2 | 3 | 5.8 | Cc1cn(Cc2cccc(Cl)c2)c2c(C(=O)N[C@@H](C)c3ccc(C(=O)O)cc3)cccc12 | 10.1016/j.bmcl.2010.04.065 | |||
53316671 | 63591 | 0 | None | -47 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | 63591 | 0 | None | -47 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | |||
44441196 | 156917 | 0 | None | -13 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.0 | CC1(c2cc(Cl)ccc2OCC(=O)O)CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL395134 | 156917 | 0 | None | -13 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.0 | CC1(c2cc(Cl)ccc2OCC(=O)O)CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
53320617 | 63600 | 0 | None | -758 | 3 | Human | 5.9 | pKi | = | 5.9 | 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 | 63600 | 0 | None | -758 | 3 | Human | 5.9 | pKi | = | 5.9 | 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 | |||
53324111 | 63610 | 0 | None | -3 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | 63610 | 0 | None | -3 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | |||
134139132 | 152834 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 568 | 11 | 2 | 8 | 2.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3918994 | 152834 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 568 | 11 | 2 | 8 | 2.8 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
53320616 | 63590 | 0 | None | -537 | 3 | Human | 5.9 | pKi | = | 5.9 | 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 | 63590 | 0 | None | -537 | 3 | Human | 5.9 | pKi | = | 5.9 | 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 | |||
56665068 | 71598 | 0 | None | 3 | 4 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819622 | 71598 | 0 | None | 3 | 4 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
56665068 | 71598 | 0 | None | 3 | 4 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819622 | 71598 | 0 | None | 3 | 4 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 500 | 7 | 2 | 5 | 5.1 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
44591458 | 186778 | 0 | None | 213 | 2 | Human | 7.9 | pKi | = | 7.9 | 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 | 186778 | 0 | None | 213 | 2 | Human | 7.9 | pKi | = | 7.9 | 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 | |||
44394432 | 134104 | 0 | None | -1 | 5 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL365908 | 134104 | 0 | None | -1 | 5 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@H]2COc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
53323268 | 63601 | 0 | None | -26 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | 63601 | 0 | None | -26 | 3 | Human | 6.9 | pKi | = | 6.9 | 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 | |||
134146324 | 155952 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 560 | 10 | 2 | 9 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3943626 | 155952 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 560 | 10 | 2 | 9 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
46890659 | 13731 | 0 | None | -2238 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 5.9 | C[C@H](NC(=O)c1cccc2ccn(Cc3ccc(C(F)(F)F)cc3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1084553 | 13731 | 0 | None | -2238 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 5.9 | C[C@H](NC(=O)c1cccc2ccn(Cc3ccc(C(F)(F)F)cc3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
56681898 | 71209 | 0 | None | 6 | 2 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813281 | 71209 | 0 | None | 6 | 2 | Mouse | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 516 | 6 | 1 | 6 | 5.3 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
24765675 | 13447 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 6.2 | C[C@H](NC(=O)c1cccc2c(Cl)cn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1083445 | 13447 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 6.2 | C[C@H](NC(=O)c1cccc2c(Cl)cn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
53319321 | 63599 | 0 | None | -7 | 3 | Human | 7.8 | pKi | = | 7.8 | 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 | 63599 | 0 | None | -7 | 3 | Human | 7.8 | pKi | = | 7.8 | 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 | |||
10227894 | 71194 | 0 | None | -1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813123 | 71194 | 0 | None | -1 | 2 | Mouse | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
134144574 | 157597 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 469 | 8 | 1 | 7 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
CHEMBL3956848 | 157597 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 469 | 8 | 1 | 7 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
118134876 | 158334 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 516 | 9 | 1 | 9 | 2.8 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | |||
CHEMBL3963140 | 158334 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 516 | 9 | 1 | 9 | 2.8 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)o1 | nan | |||
56658146 | 71593 | 0 | None | - | 1 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1ccc(F)c(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819617 | 71593 | 0 | None | - | 1 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1ccc(F)c(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
53322785 | 63603 | 0 | None | -4 | 3 | Human | 7.8 | pKi | = | 7.8 | 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 | 63603 | 0 | None | -4 | 3 | Human | 7.8 | pKi | = | 7.8 | 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 | |||
11314979 | 72883 | 0 | None | 11 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 379 | 7 | 1 | 4 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(C)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL183933 | 72883 | 0 | None | 11 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 379 | 7 | 1 | 4 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(C)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44393681 | 73635 | 0 | None | 1 | 3 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(CCC)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL186244 | 73635 | 0 | None | 1 | 3 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(CCC)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
134149663 | 155041 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 518 | 9 | 1 | 9 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3936481 | 155041 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 518 | 9 | 1 | 9 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
46853755 | 75306 | 1 | None | -794 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 3.7 | CCCS(=O)(=O)c1ccc(C)c(C#Cc2cc(Cl)ccc2OCC(=O)O)c1 | 10.1021/jm200866y | |||
CHEMBL1917584 | 75306 | 1 | None | -794 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 3.7 | CCCS(=O)(=O)c1ccc(C)c(C#Cc2cc(Cl)ccc2OCC(=O)O)c1 | 10.1021/jm200866y | |||
44411809 | 84146 | 0 | None | -2 | 2 | Human | 7.8 | pKi | = | 7.8 | 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 | 84146 | 0 | None | -2 | 2 | Human | 7.8 | pKi | = | 7.8 | 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 | |||
53321678 | 63612 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 426 | 6 | 1 | 4 | 3.5 | CCc1ccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643799 | 63612 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 426 | 6 | 1 | 4 | 3.5 | CCc1ccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
56661652 | 71584 | 0 | None | 169 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819609 | 71584 | 0 | None | 169 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
10116114 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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.2011.08.065 | |||
CHEMBL364841 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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.2011.08.065 | |||
24765672 | 13861 | 0 | None | -5 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 2 | 3 | 5.5 | C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1085081 | 13861 | 0 | None | -5 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 2 | 3 | 5.5 | C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
56661652 | 71584 | 0 | None | 169 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819609 | 71584 | 0 | None | 169 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 7 | 2 | 5 | 4.5 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
10116114 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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 | 132664 | 0 | None | -3 | 8 | Mouse | 7.8 | pKi | = | 7.8 | 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 | |||
11742649 | 190908 | 0 | None | 39 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccnc2c1c(Sc1ccccc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL482743 | 190908 | 0 | None | 39 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccnc2c1c(Sc1ccccc1)c1n2CCCC1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
59232282 | 151381 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)C(C)C2)cc1 | nan | |||
CHEMBL3907812 | 151381 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)C(C)C2)cc1 | nan | |||
134145151 | 157587 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 452 | 8 | 1 | 6 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3956785 | 157587 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 452 | 8 | 1 | 6 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
134144732 | 157320 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 531 | 11 | 2 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3954700 | 157320 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 531 | 11 | 2 | 7 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134144853 | 157359 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3955068 | 157359 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
25003075 | 13610 | 18 | None | -5888 | 7 | Human | 5.8 | pKi | = | 5.8 | 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 | 13610 | 18 | None | -5888 | 7 | Human | 5.8 | pKi | = | 5.8 | 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 | |||
56672020 | 71599 | 0 | None | 1 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819623 | 71599 | 0 | None | 1 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
56678743 | 71597 | 0 | None | - | 1 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819621 | 71597 | 0 | None | - | 1 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
56672020 | 71599 | 0 | None | 1 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819623 | 71599 | 0 | None | 1 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3F)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
10183680 | 133944 | 0 | None | 1 | 3 | Human | 6.8 | pKi | = | 6.8 | 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.bmcl.2004.07.039 | |||
CHEMBL365696 | 133944 | 0 | None | 1 | 3 | Human | 6.8 | pKi | = | 6.8 | 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.bmcl.2004.07.039 | |||
21974464 | 73778 | 0 | None | 12 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 427 | 8 | 1 | 4 | 5.3 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL186925 | 73778 | 0 | None | 12 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 427 | 8 | 1 | 4 | 5.3 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
59232380 | 150778 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 543 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3902817 | 150778 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 543 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134135625 | 151004 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 545 | 10 | 2 | 10 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
CHEMBL3904534 | 151004 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 545 | 10 | 2 | 10 | 2.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
91981657 | 152742 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ncco4)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
CHEMBL3918212 | 152742 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4ncco4)c(OCC(=O)O)c3)CC2)cn1 | nan | |||
10139183 | 74997 | 0 | None | 1 | 2 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.2 | CN1C[C@@H](COc2ccc(C(=O)n3ccc4c(CC(=O)O)cccc43)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1915669 | 74997 | 0 | None | 1 | 2 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.2 | CN1C[C@@H](COc2ccc(C(=O)n3ccc4c(CC(=O)O)cccc43)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
56675398 | 71583 | 0 | None | 204 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819608 | 71583 | 0 | None | 204 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.065 | |||
56675398 | 71583 | 0 | None | 204 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819608 | 71583 | 0 | None | 204 | 2 | Mouse | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 7 | 2 | 5 | 4.2 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
21974362 | 128822 | 0 | None | 1 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2COc3ccccc3C2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL359564 | 128822 | 0 | None | 1 | 4 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2COc3ccccc3C2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
44234032 | 154703 | 0 | None | -263 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | |||
CHEMBL3933704 | 154703 | 0 | None | -263 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 8 | 1 | 4 | 5.0 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2cccc(F)c2)CC1 | 10.1021/acs.jmedchem.6b00871 | |||
11625836 | 142991 | 0 | None | -97 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 4 | 1 | 4 | 4.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1cc(Cl)ccc1Cl | 10.1021/jm050519b | |||
CHEMBL373294 | 142991 | 0 | None | -97 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 4 | 1 | 4 | 4.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1cc(Cl)ccc1Cl | 10.1021/jm050519b | |||
11514705 | 160455 | 0 | None | -31 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.2 | O=C(O)COc1ccc(Cl)cc1C1CCCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL398126 | 160455 | 0 | None | -31 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.2 | O=C(O)COc1ccc(Cl)cc1C1CCCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
56675400 | 71591 | 0 | None | - | 1 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819615 | 71591 | 0 | None | - | 1 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.065 | |||
56675400 | 71591 | 0 | None | - | 1 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819615 | 71591 | 0 | None | - | 1 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1F | 10.1016/j.bmc.2011.08.007 | |||
11418818 | 73436 | 0 | None | 7 | 4 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 423 | 10 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(C)c(CCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL185369 | 73436 | 0 | None | 7 | 4 | Mouse | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 423 | 10 | 1 | 5 | 5.2 | CCCCOc1ccc(C(=O)n2c(C)c(CCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
11338015 | 72892 | 0 | None | 1 | 2 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 381 | 7 | 2 | 5 | 4.2 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(O)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL183983 | 72892 | 0 | None | 1 | 2 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 381 | 7 | 2 | 5 | 4.2 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(O)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
44411635 | 85002 | 0 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | 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 | 85002 | 0 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | 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 | |||
59232290 | 159522 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3973247 | 159522 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Br)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134145262 | 155594 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 557 | 11 | 2 | 8 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3940951 | 155594 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 557 | 11 | 2 | 8 | 3.0 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NCc4ccco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
11189801 | 196391 | 0 | None | 5888 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | 196391 | 0 | None | 5888 | 2 | Human | 8.7 | pKi | = | 8.7 | 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 | |||
44591807 | 199346 | 0 | None | 6 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | 199346 | 0 | None | 6 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
44591514 | 198558 | 0 | None | 398 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | 198558 | 0 | None | 398 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
15157538 | 145603 | 0 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | 145603 | 0 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
11408533 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
11408533 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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/jm800219f | |||
CHEMBL383484 | 148105 | 0 | None | 89 | 3 | Human | 8.6 | pKi | = | 8.6 | 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/jm800219f | |||
10300724 | 71203 | 0 | None | 47 | 2 | Mouse | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813275 | 71203 | 0 | None | 47 | 2 | Mouse | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | |||
44411605 | 83973 | 0 | None | 117 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | 83973 | 0 | None | 117 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
14372505 | 148060 | 0 | None | 61 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | 148060 | 0 | None | 61 | 2 | Human | 8.6 | pKi | = | 8.6 | 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 | |||
21974528 | 131228 | 0 | None | 1 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL363984 | 131228 | 0 | None | 1 | 5 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
21974528 | 131228 | 0 | None | -1 | 5 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL363984 | 131228 | 0 | None | -1 | 5 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 5 | 4.6 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Cc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
9939791 | 168697 | 0 | None | -165 | 8 | Human | 5.7 | pKi | = | 5.7 | 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 | 168697 | 0 | None | -165 | 8 | Human | 5.7 | pKi | = | 5.7 | 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 | |||
134147075 | 156471 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(C(F)(F)F)c3)CC2)cc1 | nan | |||
CHEMBL3947705 | 156471 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(C(F)(F)F)c3)CC2)cc1 | nan | |||
134144455 | 157286 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 517 | 10 | 2 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3954499 | 157286 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 517 | 10 | 2 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)NC4CC4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134150792 | 158751 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 519 | 11 | 2 | 7 | 2.6 | CCCNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | |||
CHEMBL3966654 | 158751 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 519 | 11 | 2 | 7 | 2.6 | CCCNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | |||
46890660 | 13430 | 0 | None | -478 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 6 | 2 | 3 | 6.6 | C[C@H](NC(=O)c1cc(Cl)cc2ccn(Cc3ccc(C(F)(F)F)cc3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1083400 | 13430 | 0 | None | -478 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 6 | 2 | 3 | 6.6 | C[C@H](NC(=O)c1cc(Cl)cc2ccn(Cc3ccc(C(F)(F)F)cc3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
53316653 | 63588 | 0 | None | -239 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 441 | 5 | 1 | 5 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(C#N)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643776 | 63588 | 0 | None | -239 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 441 | 5 | 1 | 5 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccc(C#N)cc3n2C1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
53323246 | 63582 | 0 | None | -19 | 3 | Human | 6.7 | pKi | = | 6.7 | 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 | 63582 | 0 | None | -19 | 3 | Human | 6.7 | pKi | = | 6.7 | 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 | |||
56664920 | 71210 | 0 | None | 26 | 2 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 4.8 | Cc1cc(OC[C@@H]2COc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813282 | 71210 | 0 | None | 26 | 2 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 4.8 | Cc1cc(OC[C@@H]2COc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
21893828 | 71216 | 0 | None | 234 | 2 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2CC1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813288 | 71216 | 0 | None | 234 | 2 | Mouse | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2CC1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | |||
44393680 | 73119 | 0 | None | 4 | 2 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 367 | 7 | 1 | 5 | 4.2 | CCCCOc1ccc(C(=O)n2cc(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL185087 | 73119 | 0 | None | 4 | 2 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 367 | 7 | 1 | 5 | 4.2 | CCCCOc1ccc(C(=O)n2cc(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
134152460 | 159763 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3975257 | 159763 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 554 | 10 | 2 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134148733 | 155324 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 593 | 10 | 3 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nc5ccccc5[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3938696 | 155324 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 593 | 10 | 3 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nc5ccccc5[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
53317718 | 63602 | 0 | None | -1621 | 3 | Human | 5.6 | pKi | = | 5.6 | 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 | 63602 | 0 | None | -1621 | 3 | Human | 5.6 | pKi | = | 5.6 | 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 | |||
44411798 | 145839 | 0 | None | 77 | 2 | Human | 7.6 | pKi | = | 7.6 | 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 | 145839 | 0 | None | 77 | 2 | Human | 7.6 | pKi | = | 7.6 | 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 | |||
10206535 | 73346 | 0 | None | -43 | 4 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL185251 | 73346 | 0 | None | -43 | 4 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
10183680 | 133944 | 0 | None | -1 | 3 | Mouse | 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.bmcl.2004.07.039 | |||
CHEMBL365696 | 133944 | 0 | None | -1 | 3 | Mouse | 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.bmcl.2004.07.039 | |||
134132110 | 151422 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 8 | 1 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C#N)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3908130 | 151422 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 8 | 1 | 7 | 2.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C#N)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
59232270 | 156984 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2C)cc1 | nan | |||
CHEMBL3952004 | 156984 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 482 | 8 | 1 | 6 | 3.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2C)cc1 | nan | |||
5855 | 8426 | 7 | None | -257 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 447 | 7 | 2 | 5 | 4.3 | OC(=O)COc1cccc2c1CC[C@](C2)(O)COC(=O)N(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2005.04.047 | |||
9911469 | 8426 | 7 | None | -257 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 447 | 7 | 2 | 5 | 4.3 | OC(=O)COc1cccc2c1CC[C@](C2)(O)COC(=O)N(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2005.04.047 | |||
CHEMBL196779 | 8426 | 7 | None | -257 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 447 | 7 | 2 | 5 | 4.3 | OC(=O)COc1cccc2c1CC[C@](C2)(O)COC(=O)N(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2005.04.047 | |||
53320594 | 63581 | 6 | None | -16 | 2 | Human | 5.6 | pKi | = | 5.6 | 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 | |||
CHEMBL1643769 | 63581 | 6 | None | -16 | 2 | Human | 5.6 | pKi | = | 5.6 | 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 | |||
56658147 | 71594 | 0 | None | - | 1 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 8 | 2 | 6 | 4.2 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819618 | 71594 | 0 | None | - | 1 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 8 | 2 | 6 | 4.2 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
11951 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | |||
59232326 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | |||
CHEMBL3545043 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | nan | |||
10163305 | 71196 | 0 | None | -1 | 2 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(F)c1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813125 | 71196 | 0 | None | -1 | 2 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(F)c1 | 10.1016/j.bmc.2011.06.014 | |||
9809136 | 113666 | 0 | None | -239 | 8 | Human | 5.6 | pKi | = | 5.6 | 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 | 113666 | 0 | None | -239 | 8 | Human | 5.6 | pKi | = | 5.6 | 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 | |||
53317957 | 63585 | 0 | None | -223 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | 63585 | 0 | None | -223 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | |||
56668529 | 71600 | 0 | None | - | 1 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3ccc(F)c(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819624 | 71600 | 0 | None | - | 1 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 4.6 | CN1C[C@@H](COc2ccc(C(=O)Nc3ccc(F)c(CC(=O)O)c3)c(Cl)c2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
53325911 | 63607 | 0 | None | -28 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 3.2 | Cc1cccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)c1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643794 | 63607 | 0 | None | -28 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 3.2 | Cc1cccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)c1 | 10.1016/j.bmcl.2010.11.015 | |||
134148587 | 155037 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccoc4)c3)CC2)cc1 | nan | |||
CHEMBL3936430 | 155037 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccoc4)c3)CC2)cc1 | nan | |||
53319322 | 63611 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 428 | 6 | 1 | 5 | 2.9 | COc1ccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643798 | 63611 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 428 | 6 | 1 | 5 | 2.9 | COc1ccc(S(=O)(=O)N(C)[C@@H]2CCc3c(CC(=O)O)c4ccccc4n3C2)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
56682059 | 71595 | 0 | None | 53 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819619 | 71595 | 0 | None | 53 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.065 | |||
56682059 | 71595 | 0 | None | 53 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819619 | 71595 | 0 | None | 53 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.08.007 | |||
134136114 | 151089 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 477 | 9 | 2 | 7 | 1.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(N)=O)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3905338 | 151089 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 477 | 9 | 2 | 7 | 1.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(N)=O)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134146420 | 155959 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 10 | 2 | 9 | 3.0 | Cc1cc(C(=O)Nc2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)no1 | nan | |||
CHEMBL3943711 | 155959 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 10 | 2 | 9 | 3.0 | Cc1cc(C(=O)Nc2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)no1 | nan | |||
44219292 | 119359 | 38 | None | -870 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | |||
CHEMBL3301604 | 119359 | 38 | None | -870 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 5.5 | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00871 | |||
11395329 | 130625 | 0 | None | 17 | 2 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL362541 | 130625 | 0 | None | 17 | 2 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
134155457 | 157862 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccco4)c3)CC2)cc1 | nan | |||
CHEMBL3959030 | 157862 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 500 | 9 | 1 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4ccco4)c3)CC2)cc1 | nan | |||
44411889 | 84051 | 0 | None | 131 | 2 | Human | 7.6 | pKi | = | 7.6 | 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 | 84051 | 0 | None | 131 | 2 | Human | 7.6 | pKi | = | 7.6 | 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 | |||
10277744 | 71186 | 0 | None | 12 | 7 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813116 | 71186 | 0 | None | 12 | 7 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
11352417 | 75004 | 0 | None | 123 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c1C | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1915676 | 75004 | 0 | None | 123 | 2 | Mouse | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)Nc2cc(CC(=O)O)ccc2Cl)c1C | 10.1016/j.bmc.2011.08.065 | |||
11165749 | 172738 | 0 | None | 10 | 3 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL425167 | 172738 | 0 | None | 10 | 3 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 409 | 9 | 1 | 5 | 4.8 | CCCCOc1ccc(C(=O)n2c(C)c(CCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
9938626 | 213612 | 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 | 213612 | 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 | |||
53320618 | 63614 | 0 | None | -44 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | 63614 | 0 | None | -44 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | |||
53320595 | 63583 | 0 | None | -61 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | 63583 | 0 | None | -61 | 3 | Human | 6.6 | pKi | = | 6.6 | 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 | |||
9874010 | 213969 | 0 | None | -169 | 8 | Human | 5.5 | pKi | = | 5.5 | 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 | 213969 | 0 | None | -169 | 8 | Human | 5.5 | pKi | = | 5.5 | 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 | |||
44411813 | 146024 | 0 | None | 3 | 2 | Human | 7.5 | pKi | = | 7.5 | 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 | 146024 | 0 | None | 3 | 2 | Human | 7.5 | pKi | = | 7.5 | 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 | |||
10185612 | 71187 | 0 | None | 1 | 4 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813117 | 71187 | 0 | None | 1 | 4 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
21974448 | 73737 | 0 | None | -28 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL186735 | 73737 | 0 | None | -28 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 429 | 8 | 1 | 5 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCCOc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
11519006 | 109263 | 0 | None | -467 | 6 | Human | 5.5 | pKi | = | 5.5 | 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 | 109263 | 0 | None | -467 | 6 | Human | 5.5 | pKi | = | 5.5 | 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 | 109263 | 0 | None | -467 | 6 | Human | 5.5 | pKi | = | 5.5 | 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 | |||
10345671 | 191058 | 0 | None | 10 | 2 | Human | 8.5 | pKi | = | 8.5 | 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 | 191058 | 0 | None | 10 | 2 | Human | 8.5 | pKi | = | 8.5 | 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 | |||
10116114 | 132664 | 0 | None | 3 | 8 | Human | 8.5 | pKi | = | 8.5 | 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.bmcl.2004.07.039 | |||
CHEMBL364841 | 132664 | 0 | None | 3 | 8 | Human | 8.5 | pKi | = | 8.5 | 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.bmcl.2004.07.039 | |||
44411814 | 85012 | 0 | None | 218 | 2 | Human | 8.5 | pKi | = | 8.5 | 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 | 85012 | 0 | None | 218 | 2 | Human | 8.5 | pKi | = | 8.5 | 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 | |||
10299717 | 71191 | 0 | None | 37 | 6 | Mouse | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813120 | 71191 | 0 | None | 37 | 6 | Mouse | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
11270709 | 145042 | 0 | None | 144 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 145042 | 0 | None | 144 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
10073359 | 191082 | 0 | None | 6 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 191082 | 0 | None | 6 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
10458032 | 198998 | 0 | None | 17 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 198998 | 0 | None | 17 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
56681885 | 71193 | 0 | None | 28 | 2 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813122 | 71193 | 0 | None | 28 | 2 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | |||
56661509 | 71205 | 0 | None | 83 | 2 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 506 | 6 | 1 | 6 | 4.8 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813277 | 71205 | 0 | None | 83 | 2 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 506 | 6 | 1 | 6 | 4.8 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1F | 10.1016/j.bmc.2011.06.014 | |||
44411890 | 84052 | 0 | None | 36 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 84052 | 0 | None | 36 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
21974328 | 73044 | 0 | None | -3 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL184684 | 73044 | 0 | None | -3 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
44411896 | 83754 | 0 | None | 6 | 2 | Human | 6.5 | pKi | = | 6.5 | 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 | 83754 | 0 | None | 6 | 2 | Human | 6.5 | pKi | = | 6.5 | 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 | |||
134144246 | 157316 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 481 | 9 | 1 | 5 | 4.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(Cl)cc3CCC(=O)O)CC2)cc1 | nan | |||
CHEMBL3954675 | 157316 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 481 | 9 | 1 | 5 | 4.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(Oc3ccc(Cl)cc3CCC(=O)O)CC2)cc1 | nan | |||
53494965 | 71587 | 0 | None | 5 | 3 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819611 | 71587 | 0 | None | 5 | 3 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.065 | |||
53494965 | 71587 | 0 | None | 5 | 3 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819611 | 71587 | 0 | None | 5 | 3 | Mouse | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1ccc(CC(=O)O)cc1NC(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1C | 10.1016/j.bmc.2011.08.007 | |||
11224239 | 71578 | 0 | None | 1 | 4 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819603 | 71578 | 0 | None | 1 | 4 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.065 | |||
11224239 | 71578 | 0 | None | 1 | 4 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819603 | 71578 | 0 | None | 1 | 4 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(C(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
59232263 | 159805 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 484 | 8 | 1 | 6 | 3.8 | CC(C)Sc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3975700 | 159805 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 484 | 8 | 1 | 6 | 3.8 | CC(C)Sc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
53317642 | 63616 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 417 | 5 | 1 | 6 | 2.5 | Cc1noc(C)c1S(=O)(=O)N(C)[C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643803 | 63616 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 417 | 5 | 1 | 6 | 2.5 | Cc1noc(C)c1S(=O)(=O)N(C)[C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1 | 10.1016/j.bmcl.2010.11.015 | |||
134141795 | 153856 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3927215 | 153856 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 544 | 10 | 2 | 9 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
59232335 | 161049 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4cocn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3986455 | 161049 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4cocn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
10300616 | 71200 | 0 | None | 1 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 500 | 7 | 1 | 7 | 4.6 | COc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813272 | 71200 | 0 | None | 1 | 2 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 500 | 7 | 1 | 7 | 4.6 | COc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
15157534 | 83506 | 0 | None | -15 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 353 | 4 | 1 | 2 | 5.2 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccccc21 | 10.1016/j.bmcl.2006.02.062 | |||
CHEMBL206631 | 83506 | 0 | None | -15 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 353 | 4 | 1 | 2 | 5.2 | O=C(O)CC1CCCc2c1n(Cc1ccc(Cl)cc1)c1ccccc21 | 10.1016/j.bmcl.2006.02.062 | |||
56658149 | 71601 | 0 | None | - | 1 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 496 | 8 | 2 | 6 | 4.5 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819625 | 71601 | 0 | None | - | 1 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 496 | 8 | 2 | 6 | 4.5 | COc1ccc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2Cl)cc1CC(=O)O | 10.1016/j.bmc.2011.08.007 | |||
56678559 | 71202 | 0 | None | -3 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 6 | 5.2 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813274 | 71202 | 0 | None | -3 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 6 | 5.2 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)cc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
134146220 | 155903 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 467 | 8 | 1 | 5 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3943291 | 155903 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 467 | 8 | 1 | 5 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCC(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134149036 | 155450 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 557 | 10 | 2 | 9 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccn(C)n4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3939753 | 155450 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 557 | 10 | 2 | 9 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccn(C)n4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
59232298 | 153223 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 486 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1F | nan | |||
CHEMBL3922050 | 153223 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 486 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1F | nan | |||
45268455 | 202916 | 48 | None | -147 | 4 | Human | 6.4 | pKi | = | 6.4 | 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 | 202916 | 48 | None | -147 | 4 | Human | 6.4 | pKi | = | 6.4 | 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 | 202916 | 48 | None | -147 | 4 | Human | 6.4 | pKi | = | 6.4 | 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 | 202916 | 48 | None | -147 | 4 | Human | 6.4 | pKi | = | 6.4 | 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 | |||
56675229 | 71195 | 0 | None | -4 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(Cl)c1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813124 | 71195 | 0 | None | -4 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)c(Cl)c1 | 10.1016/j.bmc.2011.06.014 | |||
10117702 | 71201 | 0 | None | -3 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 6 | 5.2 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c1C | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813273 | 71201 | 0 | None | -3 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 6 | 5.2 | Cc1c(OC[C@@H]2CN(C)c3ccccc3O2)ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c1C | 10.1016/j.bmc.2011.06.014 | |||
134155468 | 157929 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3959547 | 157929 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(NC(=O)c4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
21974362 | 128822 | 0 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2COc3ccccc3C2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL359564 | 128822 | 0 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 4.9 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2COc3ccccc3C2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
53324589 | 63587 | 0 | None | -234 | 3 | Human | 6.4 | pKi | = | 6.4 | 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 | 63587 | 0 | None | -234 | 3 | Human | 6.4 | pKi | = | 6.4 | 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 | |||
44411797 | 146293 | 0 | None | 85 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 146293 | 0 | None | 85 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
9825028 | 191148 | 0 | None | 9 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 191148 | 0 | None | 9 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
44411552 | 83861 | 0 | None | 24 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 83861 | 0 | None | 24 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
44411851 | 84521 | 0 | None | 64 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 84521 | 0 | None | 64 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
44411799 | 85060 | 0 | None | 50 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 85060 | 0 | None | 50 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
10278907 | 71192 | 0 | None | 20 | 3 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813121 | 71192 | 0 | None | 20 | 3 | Mouse | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
22083978 | 83901 | 0 | None | 162 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | 83901 | 0 | None | 162 | 2 | Human | 8.4 | pKi | = | 8.4 | 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 | |||
53358921 | 71215 | 0 | None | 295 | 6 | Mouse | 8.3 | pKi | = | 8.3 | 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 | 71215 | 0 | None | 295 | 6 | Mouse | 8.3 | pKi | = | 8.3 | 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 | |||
11282034 | 73404 | 0 | None | 10 | 3 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 437 | 11 | 1 | 5 | 5.6 | CCCCOc1ccc(C(=O)n2c(C)c(CCCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL185277 | 73404 | 0 | None | 10 | 3 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 437 | 11 | 1 | 5 | 5.6 | CCCCOc1ccc(C(=O)n2c(C)c(CCCCC(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
9895436 | 113793 | 0 | None | -223 | 7 | Human | 5.4 | pKi | = | 5.4 | 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 | 113793 | 0 | None | -223 | 7 | Human | 5.4 | pKi | = | 5.4 | 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 | |||
46890616 | 13858 | 0 | None | -169 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 5.7 | C[C@H](NC(=O)c1cc(F)cc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1085041 | 13858 | 0 | None | -169 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 5.7 | C[C@H](NC(=O)c1cc(F)cc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
11234840 | 131833 | 0 | None | 4 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1cccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)c1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL364421 | 131833 | 0 | None | 4 | 2 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 8 | 1 | 5 | 4.5 | CCCCOc1cccc(C(=O)n2c(C)c(CC(=O)O)c3cc(OC)ccc32)c1 | 10.1016/j.bmcl.2004.06.006 | |||
56671851 | 71211 | 0 | None | 48 | 2 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813283 | 71211 | 0 | None | 48 | 2 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.1 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
56658143 | 71579 | 0 | None | -3 | 6 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 468 | 8 | 2 | 6 | 3.4 | CN1C[C@@H](COc2ccc(S(=O)(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819604 | 71579 | 0 | None | -3 | 6 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 468 | 8 | 2 | 6 | 3.4 | CN1C[C@@H](COc2ccc(S(=O)(=O)Nc3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
25908691 | 156096 | 1 | None | -58 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.2 | C[C@H](Oc1ccc(Cl)cc1C1CCCCC1)C(=O)O | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL394497 | 156096 | 1 | None | -58 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 282 | 4 | 1 | 2 | 4.2 | C[C@H](Oc1ccc(Cl)cc1C1CCCCC1)C(=O)O | 10.1016/j.bmcl.2007.05.019 | |||
24765769 | 13618 | 0 | None | -7 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 446 | 6 | 2 | 3 | 5.8 | Cc1cc2cccc(C(=O)N[C@@H](C)c3ccc(C(=O)O)cc3)c2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1084047 | 13618 | 0 | None | -7 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 446 | 6 | 2 | 3 | 5.8 | Cc1cc2cccc(C(=O)N[C@@H](C)c3ccc(C(=O)O)cc3)c2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2010.04.065 | |||
53321924 | 63609 | 0 | None | -8 | 3 | Human | 7.3 | pKi | = | 7.3 | 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 | 63609 | 0 | None | -8 | 3 | Human | 7.3 | pKi | = | 7.3 | 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 | |||
134136718 | 149379 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 9 | 1 | 8 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-n4cccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3891367 | 149379 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 9 | 1 | 8 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-n4cccn4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
134157343 | 160564 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3982208 | 160564 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 553 | 10 | 2 | 7 | 3.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4ccccc4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
248828 | 100168 | 7 | None | 1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 226 | 5 | 1 | 2 | 2.5 | C=CCc1cc(Cl)ccc1OCC(=O)O | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL245707 | 100168 | 7 | None | 1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 226 | 5 | 1 | 2 | 2.5 | C=CCc1cc(Cl)ccc1OCC(=O)O | 10.1016/j.bmcl.2007.05.019 | |||
53317569 | 63595 | 0 | None | -12 | 3 | Human | 7.3 | pKi | = | 7.3 | 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 | 63595 | 0 | None | -12 | 3 | Human | 7.3 | pKi | = | 7.3 | 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 | |||
44441193 | 160128 | 0 | None | -31 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 254 | 4 | 1 | 2 | 3.5 | O=C(O)COc1ccc(Cl)cc1C1CCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL397842 | 160128 | 0 | None | -31 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 254 | 4 | 1 | 2 | 3.5 | O=C(O)COc1ccc(Cl)cc1C1CCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
11573799 | 78769 | 0 | None | -19 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 347 | 4 | 1 | 4 | 3.0 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1ccccc1 | 10.1021/jm050519b | |||
CHEMBL197398 | 78769 | 0 | None | -19 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 347 | 4 | 1 | 4 | 3.0 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1ccccc1 | 10.1021/jm050519b | |||
46890658 | 13730 | 0 | None | -128 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 516 | 7 | 2 | 4 | 6.4 | C[C@H](NC(=O)c1cccc2ccn(Cc3cc(Cl)cc(OC(F)(F)F)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1084552 | 13730 | 0 | None | -128 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 516 | 7 | 2 | 4 | 6.4 | C[C@H](NC(=O)c1cccc2ccn(Cc3cc(Cl)cc(OC(F)(F)F)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
134136547 | 149477 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 478 | 9 | 2 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(NCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3892146 | 149477 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 478 | 9 | 2 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(NCC(=O)O)c3)CC2)cc1 | nan | |||
53358922 | 71204 | 0 | None | 38 | 6 | Mouse | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813276 | 71204 | 0 | None | 38 | 6 | Mouse | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
10206535 | 73346 | 0 | None | 43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL185251 | 73346 | 0 | None | 43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccc(F)cc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
56681899 | 71217 | 0 | None | 97 | 2 | Mouse | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 473 | 6 | 1 | 5 | 5.3 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813289 | 71217 | 0 | None | 97 | 2 | Mouse | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 473 | 6 | 1 | 5 | 5.3 | Cc1cc(OC[C@@H]2COc3ccccc32)ccc1C(=O)n1c(C)c(CC(=O)O)c2cc(F)ccc21 | 10.1016/j.bmc.2011.06.014 | |||
53321923 | 63594 | 0 | None | 4 | 3 | Human | 8.3 | pKi | = | 8.3 | 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 | 63594 | 0 | None | 4 | 3 | Human | 8.3 | pKi | = | 8.3 | 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 | |||
10228100 | 71188 | 0 | None | 43 | 5 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813118 | 71188 | 0 | None | 43 | 5 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
21974374 | 134025 | 0 | None | 1 | 5 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL365829 | 134025 | 0 | None | 1 | 5 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
134154584 | 159108 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 491 | 9 | 2 | 7 | 1.8 | CNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | |||
CHEMBL3969800 | 159108 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 491 | 9 | 2 | 7 | 1.8 | CNC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(OC(C)C)cc3)CC2)cc1OCC(=O)O | nan | |||
53316672 | 63605 | 0 | None | -6 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 3.2 | Cc1ccccc1S(=O)(=O)N(C)[C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643792 | 63605 | 0 | None | -6 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 5 | 1 | 4 | 3.2 | Cc1ccccc1S(=O)(=O)N(C)[C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1 | 10.1016/j.bmcl.2010.11.015 | |||
134143246 | 152442 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 516 | 9 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4cccs4)c3)CC2)cc1 | nan | |||
CHEMBL3915956 | 152442 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 516 | 9 | 1 | 7 | 4.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(OCC(=O)O)cc(-c4cccs4)c3)CC2)cc1 | nan | |||
15947857 | 162292 | 7 | None | -46 | 7 | Human | 7.3 | pKi | = | 7.3 | 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 | 162292 | 7 | None | -46 | 7 | Human | 7.3 | pKi | = | 7.3 | 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 | |||
56658144 | 71580 | 0 | None | -1 | 2 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(NC(=O)c3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819605 | 71580 | 0 | None | -1 | 2 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 432 | 7 | 2 | 5 | 3.8 | CN1C[C@@H](COc2ccc(NC(=O)c3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
11545850 | 77011 | 0 | None | -10232 | 3 | Human | 5.3 | pKi | = | 5.3 | 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 | 77011 | 0 | None | -10232 | 3 | Human | 5.3 | pKi | = | 5.3 | 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 | |||
53317977 | 63608 | 0 | None | -125 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccccc1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643795 | 63608 | 0 | None | -125 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 2.9 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccccc1 | 10.1016/j.bmcl.2010.11.015 | |||
53319320 | 63593 | 0 | None | -537 | 3 | Human | 6.3 | pKi | = | 6.3 | 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 | 63593 | 0 | None | -537 | 3 | Human | 6.3 | pKi | = | 6.3 | 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 | |||
25002382 | 14167 | 0 | None | -1819 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 512 | 6 | 2 | 3 | 6.5 | O=C(O)c1ccc(C2(NC(=O)c3cc(Cl)cc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1086490 | 14167 | 0 | None | -1819 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 512 | 6 | 2 | 3 | 6.5 | O=C(O)c1ccc(C2(NC(=O)c3cc(Cl)cc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
134140560 | 153517 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Br)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3924249 | 153517 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 512 | 8 | 1 | 6 | 3.2 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Br)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
118134875 | 149328 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 532 | 9 | 1 | 9 | 3.3 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)s1 | nan | |||
CHEMBL3890925 | 149328 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 532 | 9 | 1 | 9 | 3.3 | Cc1nnc(-c2ccc(N3CCN(S(=O)(=O)c4ccc(OC(C)C)cc4)CC3)cc2OCC(=O)O)s1 | nan | |||
134148187 | 156833 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 517 | 9 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3950658 | 156833 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 517 | 9 | 1 | 8 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nccs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
56668353 | 71206 | 0 | None | 2 | 2 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813278 | 71206 | 0 | None | 2 | 2 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 502 | 6 | 1 | 6 | 5.0 | Cc1cc(C(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)ccc1OC[C@@H]1CN(C)c2ccccc2O1 | 10.1016/j.bmc.2011.06.014 | |||
56668528 | 71586 | 0 | None | - | 1 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1C | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819610 | 71586 | 0 | None | - | 1 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cccc(CC(=O)O)c1C | 10.1016/j.bmc.2011.08.007 | |||
11500603 | 100292 | 4 | None | -70 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 312 | 4 | 1 | 2 | 4.0 | O=C(O)COc1ccc(Br)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL246311 | 100292 | 4 | None | -70 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 312 | 4 | 1 | 2 | 4.0 | O=C(O)COc1ccc(Br)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
10342667 | 191827 | 0 | None | 28 | 2 | Human | 8.2 | pKi | = | 8.2 | 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 | 191827 | 0 | None | 28 | 2 | Human | 8.2 | pKi | = | 8.2 | 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 | |||
44411791 | 84846 | 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 | 84846 | 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 | |||
11409320 | 75009 | 0 | None | - | 1 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1915856 | 75009 | 0 | None | - | 1 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 5.1 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)cc(C)c1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | |||
21974331 | 133324 | 0 | None | 5 | 4 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 399 | 6 | 1 | 4 | 4.8 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL365243 | 133324 | 0 | None | 5 | 4 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 399 | 6 | 1 | 4 | 4.8 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCc2ccccc2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
21974374 | 134025 | 0 | None | -1 | 5 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL365829 | 134025 | 0 | None | -1 | 5 | Mouse | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2CCc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
9802748 | 142701 | 0 | None | -3235 | 3 | Human | 5.2 | pKi | = | 5.2 | 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 | 142701 | 0 | None | -3235 | 3 | Human | 5.2 | pKi | = | 5.2 | 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 | |||
5036 | 108342 | 26 | None | -1122 | 3 | Human | 5.2 | pKi | = | 5.2 | 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 | 108342 | 26 | None | -1122 | 3 | Human | 5.2 | pKi | = | 5.2 | 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 | |||
24765768 | 13857 | 0 | None | -77 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 6.2 | C[C@H](NC(=O)c1cc(Cl)cc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1085040 | 13857 | 0 | None | -77 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 6.2 | C[C@H](NC(=O)c1cc(Cl)cc2ccn(Cc3cccc(Cl)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
134145205 | 157241 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3954204 | 157241 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(OCC(=O)O)c3)CC2)cc1 | nan | |||
11667039 | 174146 | 0 | None | -64 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 328 | 5 | 1 | 2 | 5.0 | O=C(O)COc1ccc(-c2ccc(F)cc2)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL429470 | 174146 | 0 | None | -64 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 328 | 5 | 1 | 2 | 5.0 | O=C(O)COc1ccc(-c2ccc(F)cc2)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
134157241 | 160525 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3981836 | 160525 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.1 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
11384493 | 10609 | 38 | None | -512 | 3 | Human | 6.2 | pKi | = | 6.2 | 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 | 10609 | 38 | None | -512 | 3 | Human | 6.2 | pKi | = | 6.2 | 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 | 10609 | 38 | None | -512 | 3 | Human | 6.2 | pKi | = | 6.2 | 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 | |||
134823954 | 171996 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | 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.2018.01.039 | |||
CHEMBL4229054 | 171996 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | 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.2018.01.039 | |||
11494321 | 78515 | 0 | None | -30 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 365 | 4 | 1 | 4 | 3.1 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1cccc(F)c1 | 10.1021/jm050519b | |||
CHEMBL196617 | 78515 | 0 | None | -30 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 365 | 4 | 1 | 4 | 3.1 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1cccc(F)c1 | 10.1021/jm050519b | |||
56664921 | 71212 | 0 | None | 39 | 2 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813284 | 71212 | 0 | None | 39 | 2 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.0 | Cc1cc(OC[C@@H]2Cc3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
56682058 | 71592 | 0 | None | - | 1 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(F)cc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819616 | 71592 | 0 | None | - | 1 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 464 | 7 | 2 | 5 | 4.3 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(F)cc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
44411984 | 84095 | 0 | None | 107 | 2 | Human | 8.1 | pKi | = | 8.1 | 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 | 84095 | 0 | None | 107 | 2 | Human | 8.1 | pKi | = | 8.1 | 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 | |||
10116116 | 71185 | 0 | None | 25 | 5 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813115 | 71185 | 0 | None | 25 | 5 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
56675399 | 71590 | 0 | None | 229 | 2 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | |||
CHEMBL1819614 | 71590 | 0 | None | 229 | 2 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.065 | |||
56675399 | 71590 | 0 | None | 229 | 2 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819614 | 71590 | 0 | None | 229 | 2 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 4.8 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)Nc1cc(CC(=O)O)ccc1Cl | 10.1016/j.bmc.2011.08.007 | |||
53323266 | 63597 | 0 | None | -177 | 3 | Human | 6.2 | pKi | = | 6.2 | 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 | 63597 | 0 | None | -177 | 3 | Human | 6.2 | pKi | = | 6.2 | 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 | |||
59232325 | 154030 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 482 | 9 | 1 | 6 | 3.5 | CC[C@@H](C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3928578 | 154030 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 482 | 9 | 1 | 6 | 3.5 | CC[C@@H](C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
56672018 | 71581 | 0 | None | 2 | 3 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 3.9 | CN1C[C@@H](COc2ccc(C(=O)N(C)c3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819606 | 71581 | 0 | None | 2 | 3 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 3.9 | CN1C[C@@H](COc2ccc(C(=O)N(C)c3cccc(CC(=O)O)c3)cc2)Oc2ccccc21 | 10.1016/j.bmc.2011.08.007 | |||
230826 | 100206 | 32 | None | -48 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 268 | 4 | 1 | 2 | 3.9 | O=C(O)COc1ccc(Cl)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL245908 | 100206 | 32 | None | -48 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 268 | 4 | 1 | 2 | 3.9 | O=C(O)COc1ccc(Cl)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
56668527 | 71582 | 0 | None | -1 | 4 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 460 | 8 | 1 | 5 | 4.3 | CCN(C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1)c1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819607 | 71582 | 0 | None | -1 | 4 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 460 | 8 | 1 | 5 | 4.3 | CCN(C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1)c1cccc(CC(=O)O)c1 | 10.1016/j.bmc.2011.08.007 | |||
11717784 | 131739 | 0 | None | -25 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 3.0 | COc1ccc(S(=O)(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)cc1 | 10.1021/jm050519b | |||
CHEMBL364299 | 131739 | 0 | None | -25 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 3.0 | COc1ccc(S(=O)(=O)n2c(C)c(CC(=O)O)c3cc(F)ccc32)cc1 | 10.1021/jm050519b | |||
53321925 | 63613 | 0 | None | -39 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)Cc1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643800 | 63613 | 0 | None | -39 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 3.2 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)Cc1ccc(F)cc1 | 10.1016/j.bmcl.2010.11.015 | |||
56672019 | 71588 | 0 | None | 7 | 4 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)c1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL1819612 | 71588 | 0 | None | 7 | 4 | Mouse | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 460 | 7 | 2 | 5 | 4.5 | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)c1 | 10.1016/j.bmc.2011.08.007 | |||
22083972 | 145952 | 0 | None | 1862 | 2 | Human | 8.1 | pKi | = | 8.1 | 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 | 145952 | 0 | None | 1862 | 2 | Human | 8.1 | pKi | = | 8.1 | 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 | |||
10216733 | 91011 | 49 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm0603668 | |||
CHEMBL221007 | 91011 | 49 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | CS(=O)(=O)c1cc(F)cc2c3c(n(Cc4ccc(Cl)cc4)c12)C(CC(=O)O)CC3 | 10.1021/jm0603668 | |||
14372503 | 85076 | 0 | None | 12 | 2 | Human | 7.1 | pKi | = | 7.1 | 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 | 85076 | 0 | None | 12 | 2 | Human | 7.1 | pKi | = | 7.1 | 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 | |||
59232348 | 155017 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 9 | 1 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3936228 | 155017 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 9 | 1 | 8 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(OCC(=O)O)c3)CC2)cc1 | nan | |||
21198692 | 89930 | 0 | None | -6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 7 | 1 | 2 | 6.1 | O=C(O)/C=C/c1ccccc1Cc1ccc2cc(OCc3ccccc3)ccc2c1 | 10.1016/j.bmcl.2006.08.025 | |||
CHEMBL218263 | 89930 | 0 | None | -6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 7 | 1 | 2 | 6.1 | O=C(O)/C=C/c1ccccc1Cc1ccc2cc(OCc3ccccc3)ccc2c1 | 10.1016/j.bmcl.2006.08.025 | |||
10181606 | 213130 | 0 | None | -33 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | |||
CHEMBL87371 | 213130 | 0 | None | -33 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | |||
11675335 | 79285 | 0 | None | -295 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 381 | 4 | 1 | 4 | 3.6 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm050519b | |||
CHEMBL199040 | 79285 | 0 | None | -295 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 381 | 4 | 1 | 4 | 3.6 | Cc1c(CC(=O)O)c2cc(F)ccc2n1S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm050519b | |||
59232361 | 154105 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 7 | 1 | 7 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc4ncn(CC(=O)O)c4c3)CC2)cc1 | nan | |||
CHEMBL3929181 | 154105 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 458 | 7 | 1 | 7 | 2.4 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc4ncn(CC(=O)O)c4c3)CC2)cc1 | nan | |||
134135533 | 151061 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3905053 | 151061 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 502 | 9 | 1 | 9 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(-c4nnco4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
16038404 | 153832 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 470 | 8 | 1 | 6 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3926982 | 153832 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 470 | 8 | 1 | 6 | 2.7 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3cc(F)c(F)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
145987034 | 171981 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | 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.2018.01.039 | |||
CHEMBL4228792 | 171981 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | 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.2018.01.039 | |||
24765671 | 13729 | 0 | None | -186 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 5.9 | C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(C(F)(F)F)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1084551 | 13729 | 0 | None | -186 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 466 | 6 | 2 | 3 | 5.9 | C[C@H](NC(=O)c1cccc2ccn(Cc3cccc(C(F)(F)F)c3)c12)c1ccc(C(=O)O)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
43091550 | 100490 | 1 | None | -2 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 282 | 4 | 0 | 3 | 3.9 | COC(=O)COc1ccc(Cl)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
CHEMBL247131 | 100490 | 1 | None | -2 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 282 | 4 | 0 | 3 | 3.9 | COC(=O)COc1ccc(Cl)cc1C1CCCCC1 | 10.1016/j.bmcl.2007.05.019 | |||
53325909 | 63604 | 0 | None | -52 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccccc1F | 10.1016/j.bmcl.2010.11.015 | |||
CHEMBL1643791 | 63604 | 0 | None | -52 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 416 | 5 | 1 | 4 | 3.0 | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccccc1F | 10.1016/j.bmcl.2010.11.015 | |||
21974328 | 73044 | 0 | None | 3 | 5 | Mouse | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
CHEMBL184684 | 73044 | 0 | None | 3 | 5 | Mouse | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 443 | 6 | 1 | 6 | 4.4 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OCC2Oc3ccccc3O2)cc1 | 10.1016/j.bmcl.2004.07.039 | |||
9933925 | 146339 | 0 | None | 380 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | 146339 | 0 | None | 380 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | |||
35028115 | 148777 | 5 | None | 109 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | 148777 | 5 | None | 109 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | |||
44411606 | 83928 | 0 | None | 112 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | 83928 | 0 | None | 112 | 2 | Human | 8.0 | pKi | = | 8.0 | 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 | |||
10185382 | 71189 | 0 | None | 30 | 5 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 500 | 7 | 1 | 7 | 4.6 | COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813119 | 71189 | 0 | None | 30 | 5 | Mouse | 8.0 | pKi | = | 8 | Binding | ChEMBL | 500 | 7 | 1 | 7 | 4.6 | COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
134146965 | 156436 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 583 | 11 | 3 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cc(C5CC5)n[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3947427 | 156436 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 583 | 11 | 3 | 8 | 3.3 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4cc(C5CC5)n[nH]4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
11406401 | 129889 | 0 | None | - | 1 | Mouse | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 381 | 7 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
CHEMBL361098 | 129889 | 0 | None | - | 1 | Mouse | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 381 | 7 | 1 | 5 | 4.5 | CCCCOc1ccc(C(=O)n2c(C)c(C(=O)O)c3cc(OC)ccc32)cc1 | 10.1016/j.bmcl.2004.06.006 | |||
134140462 | 153400 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 561 | 10 | 2 | 10 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
CHEMBL3923338 | 153400 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 561 | 10 | 2 | 10 | 2.6 | CC(C)Oc1ccc(S(=O)(=O)N2CCN(c3ccc(C(=O)Nc4nncs4)c(OCC(=O)O)c3)CC2)cc1 | nan | |||
1884 | 9857 | 52 | None | -213 | 22 | Human | 8.3 | pIC50 | = | 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 | 9857 | 52 | None | -213 | 22 | Human | 8.3 | pIC50 | = | 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 | 9857 | 52 | None | -213 | 22 | Human | 8.3 | pIC50 | = | 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 | 9857 | 52 | None | -213 | 22 | Human | 8.3 | pIC50 | = | 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 | 9857 | 52 | None | -213 | 22 | Human | 8.3 | pIC50 | = | 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 | |||
3356 | 9060 | 73 | None | 38 | 8 | Human | 8.0 | pKd | = | 8.0 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.0 | pKd | = | 8.0 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.0 | pKd | = | 8.0 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.0 | pKd | = | 8.0 | 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 | 9060 | 73 | None | 38 | 8 | Human | 8.0 | pKd | = | 8.0 | 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 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.7 | pKd | = | 8.7 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1876 | 8143 | 0 | None | -15 | 3 | Human | 7.0 | pKd | None | 7 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.2 | CCCCC[C@@H](C/C=C/1\[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
5280885 | 8143 | 0 | None | -15 | 3 | Human | 7.0 | pKd | None | 7 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.2 | CCCCC[C@@H](C/C=C/1\[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
CHEMBL519797 | 8143 | 0 | None | -15 | 3 | Human | 7.0 | pKd | None | 7 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.2 | CCCCC[C@@H](C/C=C/1\[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
122021 | 7543 | 0 | None | 151 | 4 | Human | 8.8 | pKd | None | 8.8 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 11082108 | |||
1897 | 7543 | 0 | None | 151 | 4 | Human | 8.8 | pKd | None | 8.8 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 11082108 | |||
1899 | 7543 | 0 | None | 151 | 4 | Human | 8.8 | pKd | None | 8.8 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 11082108 | |||
None | 223192 | 0 | 3H-PGD2 | 6 | 6 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 384 | 9 | 3 | 3 | 4.3 | C1CCC(CC1)C(C=CC2C(CC(C2CC=CCCCC(=O)O)Cl)O)O | None | |||
119304 | 7539 | 0 | 3H-PGD2 | 22 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
1878 | 7539 | 0 | 3H-PGD2 | 22 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
40481312 | 7539 | 0 | 3H-PGD2 | 22 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
CHEMBL575504 | 7539 | 0 | 3H-PGD2 | 22 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
1881 | 9853 | 0 | 3H-PGD2 | 4 | 21 | Human | 8.8 | pKi | = | 8.8 | 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 | 9853 | 0 | 3H-PGD2 | 4 | 21 | Human | 8.8 | pKi | = | 8.8 | 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 | 9853 | 0 | 3H-PGD2 | 4 | 21 | Human | 8.8 | pKi | = | 8.8 | 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 | 9853 | 0 | 3H-PGD2 | 4 | 21 | Human | 8.8 | pKi | = | 8.8 | 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 | 9853 | 0 | 3H-PGD2 | 4 | 21 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
1940 | 8444 | 41 | 3H-PGD2 | -4168 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 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 | None | |||
3417 | 8444 | 41 | 3H-PGD2 | -4168 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 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 | None | |||
5311100 | 8444 | 41 | 3H-PGD2 | -4168 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 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 | None | |||
CHEMBL1201379 | 8444 | 41 | 3H-PGD2 | -4168 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 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 | None | |||
DB11519 | 8444 | 41 | 3H-PGD2 | -4168 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 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 | None | |||
1551 | 9066 | 0 | 3H-PGD2 | -1412 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1961 | 9066 | 0 | 3H-PGD2 | -1412 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
5311221 | 9066 | 0 | 3H-PGD2 | -1412 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
CHEMBL1051 | 9066 | 0 | 3H-PGD2 | -1412 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
DB00654 | 9066 | 0 | 3H-PGD2 | -1412 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1913 | 9242 | 0 | 3H-PGD2 | -70794 | 15 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
5311223 | 9242 | 0 | 3H-PGD2 | -70794 | 15 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
1817 | 9320 | 68 | 3H-PGD2 | -269 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1936 | 9320 | 68 | 3H-PGD2 | -269 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
5282381 | 9320 | 68 | 3H-PGD2 | -269 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
CHEMBL606 | 9320 | 68 | 3H-PGD2 | -269 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
DB00929 | 9320 | 68 | 3H-PGD2 | -269 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1980 | 10434 | 0 | 3H-PGD2 | -10000 | 9 | Human | 5.0 | pKi | = | 5 | 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 | 10434 | 0 | 3H-PGD2 | -10000 | 9 | Human | 5.0 | pKi | = | 5 | 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 | 10434 | 0 | 3H-PGD2 | -10000 | 9 | Human | 5.0 | pKi | = | 5 | 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 | |||
5311035 | 104579 | 29 | 3H-PGD2 | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | |||
CHEMBL271896 | 104579 | 29 | 3H-PGD2 | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | |||
134689669 | 222829 | 0 | 3H-PGD2 | -5495 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
91798918 | 222842 | 0 | 3H-PGD2 | -1479 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
67861203 | 222844 | 0 | 3H-PGD2 | -21379 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 424 | 11 | 4 | 5 | 3.2 | C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O | None | |||
132748 | 223191 | 0 | 3H-PGD2 | -7 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 3 | 2 | 4 | 4.6 | C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CCC4=CC=NC=C4)C=C(C=C3)Cl.Cl | None | |||
None | 223236 | 0 | 3H-PGD2 | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 334 | 12 | 2 | 3 | 4.1 | CCCCCC(C=CC1C=CC(=O)C1CC=CCCCC(=O)O)O | None | |||
None | 223237 | 0 | 3H-PGD2 | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 334 | 12 | 2 | 3 | 4.3 | CCCCCC(C=CC1=C(C(=O)CC1)CC=CCCCC(=O)O)O | None | |||
89077401 | 222823 | 0 | 3H-PGD2 | -93 | 12 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)C(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
133126726 | 222824 | 0 | 3H-PGD2 | -12 | 14 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
24868263 | 222824 | 0 | 3H-PGD2 | -12 | 14 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
1917 | 7714 | 0 | 3H-PGD2 | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
5311044 | 7714 | 0 | 3H-PGD2 | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
631 | 7714 | 0 | 3H-PGD2 | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
CHEMBL160629 | 7714 | 0 | 3H-PGD2 | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
None | 223193 | 0 | 3H-PGD2 | 4 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 477 | 11 | 1 | 5 | 5.1 | C1CC(=O)CC1CCC(=CCC(C(=O)O)N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4 | None | |||
119461 | 7108 | 72 | 3H-PGD2 | -4 | 10 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
1896 | 7108 | 72 | 3H-PGD2 | -4 | 10 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
CHEMBL1317823 | 7108 | 72 | 3H-PGD2 | -4 | 10 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
None | 222822 | 0 | 3H-PGD2 | -69 | 5 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 366 | 12 | 2 | 3 | 5.2 | CCCCCC(C=CC1CC2CC(C1CC=CCCCC(=O)O)S2)O | None | |||
1881 | 9853 | 0 | 3H-PGD2 | -10 | 21 | Rat | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -10 | 21 | Rat | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -10 | 21 | Rat | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -10 | 21 | Rat | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -10 | 21 | Rat | 7.7 | pKi | = | 7.7 | 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 | |||
1881 | 9853 | 0 | 3H-PGD2 | -9 | 21 | Mouse | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -9 | 21 | Mouse | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -9 | 21 | Mouse | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -9 | 21 | Mouse | 7.7 | pKi | = | 7.7 | 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 | 9853 | 0 | 3H-PGD2 | -9 | 21 | Mouse | 7.7 | pKi | = | 7.7 | 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 | |||
119304 | 7539 | 0 | 3H-PGD2 | -354 | 9 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
1878 | 7539 | 0 | 3H-PGD2 | -354 | 9 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
40481312 | 7539 | 0 | 3H-PGD2 | -354 | 9 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
CHEMBL575504 | 7539 | 0 | 3H-PGD2 | -354 | 9 | Mouse | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
None | 223234 | 0 | 3H-PGD2 | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 366 | 12 | 2 | 5 | 3.3 | CCCCCC(C=CC1C(C(CC1=O)O)CC=CCCCC(=O)OC)O | None | |||
1883 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | 9856 | 75 | 3H-PGD2 | -2951 | 24 | Rat | 5.5 | pKi | = | 5.5 | 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 | |||
1883 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | 9856 | 75 | 3H-PGD2 | -72 | 24 | Human | 6.5 | pKi | = | 6.5 | 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 | |||
133126726 | 222824 | 0 | 3H-PGD2 | -338 | 14 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
24868263 | 222824 | 0 | 3H-PGD2 | -338 | 14 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
138 | 9855 | 88 | 3H-PGD2 | -3715 | 18 | Rat | 5.4 | pKi | = | 5.4 | 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 | 9855 | 88 | 3H-PGD2 | -3715 | 18 | Rat | 5.4 | pKi | = | 5.4 | 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 | 9855 | 88 | 3H-PGD2 | -3715 | 18 | Rat | 5.4 | pKi | = | 5.4 | 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 | 9855 | 88 | 3H-PGD2 | -3715 | 18 | Rat | 5.4 | pKi | = | 5.4 | 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 | 9855 | 88 | 3H-PGD2 | -3715 | 18 | Rat | 5.4 | pKi | = | 5.4 | 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 | |||
1888 | 10672 | 29 | 3H-PGD2 | -117 | 17 | Human | 5.4 | pKi | = | 5.4 | 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 | 10672 | 29 | 3H-PGD2 | -117 | 17 | Human | 5.4 | pKi | = | 5.4 | 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 | 10672 | 29 | 3H-PGD2 | -117 | 17 | Human | 5.4 | pKi | = | 5.4 | 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 | 10672 | 29 | 3H-PGD2 | -117 | 17 | Human | 5.4 | pKi | = | 5.4 | 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 | |||
656511 | 224495 | 0 | None | -1 | 7 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 539 | 6 | 3 | 8 | -0.2 | CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCN(C3=O)S(C)(=O)=O)C3=CC=CC=C3)C(=O)N2[C@H]1C(O)=O | None | |||
123879 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
1910 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
1911 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
2354 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
CHEMBL361812 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
DB13036 | 10060 | 82 | None | -43 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 416 | 6 | 2 | 4 | 3.1 | OC(=O)CCn1c2CC[C@H](Cc2c2c1cccc2)NS(=O)(=O)c1ccc(cc1)F | None | |||
None | 223235 | 0 | 3H-PGD2 | 19 | 3 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCCC(C=CC1C(C(CC1=O)O)CCCCCCC(=O)O)O | None | |||
138107701 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | 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 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | 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 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | 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 | |||
1884 | 9857 | 52 | 3H-PGD2 | -208 | 22 | Rat | 6.2 | pKi | = | 6.2 | 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 | 9857 | 52 | 3H-PGD2 | -208 | 22 | Rat | 6.2 | pKi | = | 6.2 | 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 | 9857 | 52 | 3H-PGD2 | -208 | 22 | Rat | 6.2 | pKi | = | 6.2 | 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 | 9857 | 52 | 3H-PGD2 | -208 | 22 | Rat | 6.2 | pKi | = | 6.2 | 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 | 9857 | 52 | 3H-PGD2 | -208 | 22 | Rat | 6.2 | pKi | = | 6.2 | 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 | |||
None | 223193 | 0 | 3H-PGD2 | 4 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 477 | 11 | 1 | 5 | 5.1 | C1CC(=O)CC1CCC(=CCC(C(=O)O)N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4 | None | |||
1883 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | 9856 | 75 | None | -72 | 24 | Human | 8.2 | pKi | = | 8.2 | 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 | |||
2720 | 10626 | 59 | None | 1 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | None | |||
5820 | 10626 | 59 | None | 1 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | None | |||
6918140 | 10626 | 59 | None | 1 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | None | |||
CHEMBL1237119 | 10626 | 59 | None | 1 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | None | |||
DB00374 | 10626 | 59 | None | 1 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | None | |||
1884 | 9857 | 52 | 3H-PGD2 | -213 | 22 | Human | 6.1 | pKi | = | 6.1 | 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 | 9857 | 52 | 3H-PGD2 | -213 | 22 | Human | 6.1 | pKi | = | 6.1 | 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 | 9857 | 52 | 3H-PGD2 | -213 | 22 | Human | 6.1 | pKi | = | 6.1 | 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 | 9857 | 52 | 3H-PGD2 | -213 | 22 | Human | 6.1 | pKi | = | 6.1 | 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 | 9857 | 52 | 3H-PGD2 | -213 | 22 | Human | 6.1 | pKi | = | 6.1 | 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 | |||
11951 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | None | |||
59232326 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | None | |||
CHEMBL3545043 | 7281 | 41 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 501 | 9 | 1 | 8 | 3.1 | CC(C)Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(c(cc1)c1ncco1)OCC(=O)O | None | |||
1895 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | |||
1895 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 22480736 | |||
1895 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 9579725 | |||
6435378 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 22480736 | |||
6435378 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 9579725 | |||
CHEMBL236025 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 22480736 | |||
CHEMBL236025 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 9579725 | |||
DB01088 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 22480736 | |||
DB01088 | 8788 | 0 | None | -50 | 16 | Human | 6.3 | pKi | = | 6.3 | 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 | 9579725 | |||
1890 | 10917 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | 400 | 9 | 3 | 4 | 3.4 | OC(=O)COC/C=C\C[C@H]1[C@H](Cl)C[C@H]([C@@H]1/C=C/[C@H](C1CCCCC1C)O)O | 10772998 | |||
5311208 | 10917 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | 400 | 9 | 3 | 4 | 3.4 | OC(=O)COC/C=C\C[C@H]1[C@H](Cl)C[C@H]([C@@H]1/C=C/[C@H](C1CCCCC1C)O)O | 10772998 | |||
1886 | 10174 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 346 | 4 | 3 | 3 | 3.1 | OC(=O)CC/C=C/1\C[C@H]2[C@H]1CC[C@@H]([C@H]2C#C[C@H](C1CCCCC1)O)O | 10772998 | |||
6438966 | 10174 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 346 | 4 | 3 | 3 | 3.1 | OC(=O)CC/C=C/1\C[C@H]2[C@H]1CC[C@@H]([C@H]2C#C[C@H](C1CCCCC1)O)O | 10772998 | |||
10227892 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 15388164 | |||
10227892 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 18178816 | |||
10227892 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 21819041 | |||
8537 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 15388164 | |||
8537 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 18178816 | |||
8537 | 9722 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | Guide to Pharmacology | 484 | 6 | 1 | 6 | 4.9 | OC(=O)Cc1cccc2c1cc(n2C(=O)c1ccc(cc1)OC[C@@H]1CN(C)c2c(O1)ccc(c2)C)C | 21819041 | |||
1887 | 10433 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 362 | 9 | 2 | 3 | 4.5 | OC(=O)CCC/C=C\C[C@@H]1[C@@H]2CC[C@H]([C@H]1/C=C/[C@H](C1CCCCC1)O)O2 | 10772998 | |||
6439022 | 10433 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | Guide to Pharmacology | 362 | 9 | 2 | 3 | 4.5 | OC(=O)CCC/C=C\C[C@@H]1[C@@H]2CC[C@H]([C@H]1/C=C/[C@H](C1CCCCC1)O)O2 | 10772998 | |||
2720 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 22480736 | |||
2720 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 25542069 | |||
5820 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 22480736 | |||
5820 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 25542069 | |||
6918140 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 22480736 | |||
6918140 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 25542069 | |||
CHEMBL1237119 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 22480736 | |||
CHEMBL1237119 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 25542069 | |||
DB00374 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 22480736 | |||
DB00374 | 10626 | 59 | None | 1 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 390 | 10 | 3 | 4 | 3.6 | CCCCC[C@@H](CC[C@H]1[C@H](O)C[C@H]2[C@@H]1Cc1cccc(c1C2)OCC(=O)O)O | 25542069 | |||
1898 | 10223 | 0 | None | 15 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | 10223 | 0 | None | 15 | 2 | Human | 8.8 | pKi | = | 8.8 | 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 | |||
119304 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
119304 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 7642548 | |||
119304 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9579725 | |||
1878 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
1878 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 7642548 | |||
1878 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9579725 | |||
40481312 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
40481312 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 7642548 | |||
40481312 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9579725 | |||
CHEMBL575504 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
CHEMBL575504 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 7642548 | |||
CHEMBL575504 | 7539 | 0 | None | 22 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9579725 | |||
122021 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 2924081 | |||
122021 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 7642548 | |||
122021 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9579725 | |||
1897 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 2924081 | |||
1897 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 7642548 | |||
1897 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9579725 | |||
1899 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 2924081 | |||
1899 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 7642548 | |||
1899 | 7543 | 0 | None | 151 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9579725 | |||
1879 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
1879 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 9579725 | |||
9908595 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
9908595 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 9579725 | |||
CHEMBL117168 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
CHEMBL117168 | 9013 | 0 | None | 223 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 9579725 | |||
1917 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
5311044 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
631 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
CHEMBL160629 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
1894 | 7744 | 41 | None | -4073 | 5 | Human | 4.8 | pKi | None | 4.8 | 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 | 7744 | 41 | None | -4073 | 5 | Human | 4.8 | pKi | None | 4.8 | 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 | 7744 | 41 | None | -4073 | 5 | Human | 4.8 | pKi | None | 4.8 | 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 | 7744 | 41 | None | -4073 | 5 | Human | 4.8 | pKi | None | 4.8 | 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 | |||
1892 | 7534 | 20 | None | -199 | 9 | Human | 4.9 | pKi | None | 4.9 | 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 | 7534 | 20 | None | -199 | 9 | Human | 4.9 | pKi | None | 4.9 | 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 | 7534 | 20 | None | -199 | 9 | Human | 4.9 | pKi | None | 4.9 | 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 | |||
1888 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | |||
1888 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 9579725 | |||
1974 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 9579725 | |||
5311493 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 9579725 | |||
CHEMBL521784 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 10672 | 29 | None | -117 | 17 | Human | 5.7 | pKi | None | 5.7 | 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 | 9579725 | |||
119461 | 7108 | 72 | None | -4 | 10 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10634944 | |||
1896 | 7108 | 72 | None | -4 | 10 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10634944 | |||
CHEMBL1317823 | 7108 | 72 | None | -4 | 10 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | 10634944 | |||
1884 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | |||
1884 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9579725 | |||
5280363 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9579725 | |||
912 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9579725 | |||
CHEMBL815 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9579725 | |||
DB12789 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9857 | 52 | None | -213 | 22 | Human | 6.3 | pKi | None | 6.3 | 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 | 9579725 | |||
1877 | 6809 | 0 | None | -79 | 3 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 316 | 11 | 1 | 2 | 5.0 | CCCCC/C=C\C=C\1/[C@@H](C/C=C\CCCC(=O)O)C=CC1=O | 9579725 | |||
5283035 | 6809 | 0 | None | -79 | 3 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 316 | 11 | 1 | 2 | 5.0 | CCCCC/C=C\C=C\1/[C@@H](C/C=C\CCCC(=O)O)C=CC1=O | 9579725 | |||
CHEMBL520218 | 6809 | 0 | None | -79 | 3 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 316 | 11 | 1 | 2 | 5.0 | CCCCC/C=C\C=C\1/[C@@H](C/C=C\CCCC(=O)O)C=CC1=O | 9579725 | |||
119304 | 7539 | 0 | None | -354 | 9 | Mouse | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9313928 | |||
1878 | 7539 | 0 | None | -354 | 9 | Mouse | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9313928 | |||
40481312 | 7539 | 0 | None | -354 | 9 | Mouse | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9313928 | |||
CHEMBL575504 | 7539 | 0 | None | -354 | 9 | Mouse | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 9313928 | |||
122021 | 7543 | 0 | None | -151 | 4 | Mouse | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9313928 | |||
1897 | 7543 | 0 | None | -151 | 4 | Mouse | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9313928 | |||
1899 | 7543 | 0 | None | -151 | 4 | Mouse | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | 9313928 | |||
1883 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | |||
1883 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
1883 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
1916 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
1916 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
5280360 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
5280360 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
913 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
913 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
CHEMBL548 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
CHEMBL548 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
DB00917 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 7642548 | |||
DB00917 | 9856 | 75 | None | -72 | 24 | Human | 6.8 | pKi | None | 6.8 | 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 | 9579725 | |||
1879 | 9013 | 0 | None | -223 | 2 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
9908595 | 9013 | 0 | None | -223 | 2 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
CHEMBL117168 | 9013 | 0 | None | -223 | 2 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 393 | 12 | 2 | 4 | 3.9 | CCCCCC(CCN1C(CCCc2ccc(cc2)C(=O)O)SCC1=O)O | 10448933 | |||
1893 | 7582 | 0 | None | -8 | 13 | Human | 6.9 | pKi | None | 6.9 | 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 | 7582 | 0 | None | -8 | 13 | Human | 6.9 | pKi | None | 6.9 | 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 | 7582 | 0 | None | -8 | 13 | Human | 6.9 | pKi | None | 6.9 | 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 | |||
138 | 9855 | 88 | None | -50 | 18 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1882 | 9855 | 88 | None | -50 | 18 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
5280723 | 9855 | 88 | None | -50 | 18 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
CHEMBL495 | 9855 | 88 | None | -50 | 18 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
DB00770 | 9855 | 88 | None | -50 | 18 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1880 | 9042 | 41 | None | -2 | 3 | Human | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
44450494 | 9042 | 41 | None | -2 | 3 | Human | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
CHEMBL264421 | 9042 | 41 | None | -2 | 3 | Human | 7.4 | pKi | None | 7.4 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)CC1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
1881 | 9853 | 0 | None | -10 | 21 | Rat | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
1891 | 9853 | 0 | None | -10 | 21 | Rat | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
448457 | 9853 | 0 | None | -10 | 21 | Rat | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
CHEMBL1235252 | 9853 | 0 | None | -10 | 21 | Rat | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
DB02056 | 9853 | 0 | None | -10 | 21 | Rat | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
1881 | 9853 | 0 | None | -9 | 21 | Mouse | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 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 | 9313928 | |||
1891 | 9853 | 0 | None | -9 | 21 | Mouse | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 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 | 9313928 | |||
448457 | 9853 | 0 | None | -9 | 21 | Mouse | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 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 | 9313928 | |||
CHEMBL1235252 | 9853 | 0 | None | -9 | 21 | Mouse | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 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 | 9313928 | |||
DB02056 | 9853 | 0 | None | -9 | 21 | Mouse | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 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 | 9313928 | |||
119304 | 7539 | 0 | None | -22 | 9 | Rat | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
1878 | 7539 | 0 | None | -22 | 9 | Rat | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
40481312 | 7539 | 0 | None | -22 | 9 | Rat | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
CHEMBL575504 | 7539 | 0 | None | -22 | 9 | Rat | 7.8 | pKi | None | 7.8 | Binding | Guide to Pharmacology | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | 10448933 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 7642548 | |||
1881 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 7642548 | |||
1891 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 7642548 | |||
448457 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 7642548 | |||
CHEMBL1235252 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 10448933 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 16604093 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 7642548 | |||
DB02056 | 9853 | 0 | None | 4 | 21 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 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 | 9579725 | |||
1885 | 9860 | 0 | None | 6 | 3 | Human | 9.0 | pKi | None | 9 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
5280884 | 9860 | 0 | None | 6 | 3 | Human | 9.0 | pKi | None | 9 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
CHEMBL1397260 | 9860 | 0 | None | 6 | 3 | Human | 9.0 | pKi | None | 9 | Binding | Guide to Pharmacology | 334 | 12 | 2 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O)O | 9579725 | |||
1889 | 10916 | 0 | None | 501 | 2 | Human | 9.5 | pKi | None | 9.5 | Binding | Guide to Pharmacology | 384 | 9 | 3 | 3 | 4.3 | OC(=O)CCC/C=C\CC1[C@H](Cl)C[C@H]([C@@H]1/C=C/[C@H](C1CCCCC1)O)O | 9579725 | |||
5311503 | 10916 | 0 | None | 501 | 2 | Human | 9.5 | pKi | None | 9.5 | Binding | Guide to Pharmacology | 384 | 9 | 3 | 3 | 4.3 | OC(=O)CCC/C=C\CC1[C@H](Cl)C[C@H]([C@@H]1/C=C/[C@H](C1CCCCC1)O)O | 9579725 |