HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q8TDS4 | HCAR2_HUMAN | Hydroxycarboxylic acid receptor 2 (HCAR2)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL483336 OBDepict O N H N O OH O Cl OH IC50 = 1.0 nM 414.85 O=C(CCc1noc2c1ccc1c(Cl)c(O)ccc12)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL483337 OBDepict O N H O OH N N OH IC50 = 1.0 nM 379.42 O=C(CCc1cnn2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL236162 OBDepict O NH S O OH N Cl HO IC50 = 1.0 nM 402.86 O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL1770352 OBDepict O N H H 2 N H O N N O OH N HO IC50 = 1.0 nM 369.34 N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1772682 single protein format
CHEMBL1084657 OBDepict HO N N N O F F F F N H O O OH Ki = 1.4 nM 430.31 O=C(O)C1=C(NC(=O)C(F)(F)C(F)(F)c2nc(-c3ccc(O)cn3)no2)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL1087302 OBDepict O N H O N O OH N N OH Ki = 3.0 nM 358.35 O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL1083138 OBDepict O N H O HO F F HO IC50 = 3.0 nM 451.47 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL520299 OBDepict O N H N O HO O OH IC50 = 3.0 nM 376.37 O=C(CCc1noc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL483139 OBDepict O N H N O OH O OH IC50 = 3.0 nM 380.4 O=C(CCc1noc2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL1084576 OBDepict CH 3 N H O HO O O N N N HO IC50 = 4.0 nM 400.44 CCCC1CCC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1087302 OBDepict O N H O N O OH N N OH IC50 = 4.0 nM 358.35 O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL483353 OBDepict O N H N O HO O OH IC50 = 4.0 nM 378.38 O=C(CCc1noc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1770353 OBDepict O N H H 2 N H O N N O OH N HO IC50 = 4.0 nM 369.34 N[C@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1772682 single protein format
CHEMBL237248 OBDepict O NH O N O OH N N HO Ki = 4.0 nM 354.32 O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1105987 cell-based format
CHEMBL1086657 OBDepict HO N N N O H 3 C H 3 C N H O O HO Ki = 4.0 nM 386.41 CC(C)(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL235256 OBDepict O NH O OH Cl HO IC50 = 4.0 nM 395.84 O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL237248 OBDepict O NH O N O OH N N HO IC50 = 4.0 nM 354.32 O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL485196 OBDepict O N H N O OH O OH IC50 = 4.0 nM 382.42 O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL520513 OBDepict O HN N O OH N S OH IC50 = 5.0 nM 385.45 O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL483352 OBDepict O N H N O HO H N OH IC50 = 5.0 nM 375.38 O=C(CCc1[nH]nc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1085616 OBDepict O N H CH 3 N N O OH N F F HO IC50 = 5.0 nM 482.49 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085156 OBDepict O N H N O HO N N HO IC50 = 5.0 nM 356.38 O=C(CCc1ccn(-c2ccc(O)cn2)n1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1770355 OBDepict O N H H 2 N H O N N O HO N HO IC50 = 5.0 nM 373.37 N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1772682 single protein format
CHEMBL1086354 OBDepict CH 3 N H O OH O OH IC50 = 6.0 nM 395.5 CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1084799 OBDepict O N H O N H CH 3 O HO N H N F F F F IC50 = 6.0 nM 504.44 C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1086541 OBDepict O HN H 3 C N N O HO N F F HO IC50 = 6.0 nM 482.49 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2F)C1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL483140 OBDepict O N H N O OH O F OH IC50 = 6.0 nM 398.39 O=C(CCc1noc2c1ccc1c(F)c(O)ccc12)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL1084030 OBDepict O N H O N O OH N N F OH IC50 = 7.0 nM 452.44 O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1085148 OBDepict O N H O OH N CH 3 N N OH IC50 = 7.0 nM 370.41 Cc1c(CCC(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085414 OBDepict O N H O HO F HO IC50 = 7.4 nM 433.48 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1086225 OBDepict O N H O N H CH 3 O HO N H N F HO IC50 = 8.0 nM 466.47 C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cccc(F)c1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL235954 OBDepict O NH S O OH Cl HO IC50 = 8.0 nM 401.87 O=C(CCc1ccc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL1086353 OBDepict H 3 C N H O HO O HO IC50 = 8.0 nM 381.47 CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL482698 OBDepict O N H O OH OH IC50 = 8.0 nM 339.39 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL521326 OBDepict O N H N O HO N N OH IC50 = 8.0 nM 376.37 O=C(CCc1nnn2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1086656 OBDepict O N H CH 3 O N N O HO N HO Ki = 8.0 nM 372.38 CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL1085655 OBDepict O N H O OH OH F IC50 = 8.6 nM 433.48 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)cc2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1082823 OBDepict H 3 C N H O HO O CH 3 N N N OH IC50 = 9.0 nM 412.49 CCCC1CCC(C(=O)O)=C(NC(=O)C(C)Cc2ccn(-c3ccc(O)cn3)n2)C1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL235952 OBDepict O NH O OH N HO IC50 = 9.0 nM 362.39 O=C(CCc1ccc(-c2ccc(O)cn2)cc1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL1084031 OBDepict O N H O N O OH N N N F OH IC50 = 9.0 nM 453.43 O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1083442 OBDepict O N H O N O OH N N F F F F IC50 = 9.0 nM 490.41 O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL391813 OBDepict O NH O N O OH N HO IC50 = 10.0 nM 353.33 O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL1084059 OBDepict O NH CH 3 N N O OH N HO IC50 = 10.0 nM 370.41 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085653 OBDepict O N H O HO F HO IC50 = 11.0 nM 433.48 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2F)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1770356 OBDepict O NH NH 2 H O N N H H 3 C O OH N HO IC50 = 11.0 nM 387.4 C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)C1 Homo sapiens CHEMBL1772682 single protein format
CHEMBL484783 OBDepict O NH N O OH N S OH IC50 = 11.0 nM 381.41 O=C(CCc1cn2c(n1)sc1cc(O)ccc12)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1086658 OBDepict OH N N N O NH O O OH Ki = 11.0 nM 384.39 O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CC2)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL1770358 OBDepict O NH NH 2 H O N N H H 3 C O OH N F IC50 = 12.0 nM 389.39 C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(F)cn3)no2)C1 Homo sapiens CHEMBL1772682 single protein format
CHEMBL1085589 OBDepict O N H O N H CH 3 O HO N H N F F F HO IC50 = 12.0 nM 502.45 C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1082824 OBDepict O HN H 3 C N N O HO N F HO IC50 = 12.0 nM 464.5 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2)C1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL4063682 OBDepict O N H O HO HO IC50 = 13.0 nM 313.35 O=C(CCC#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL482768 OBDepict O N H O HO N N OH IC50 = 13.0 nM 377.4 O=C(CCc1cnn2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL485326 OBDepict O N H N O HO O HO IC50 = 13.0 nM 368.39 O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL1770173 OBDepict O HN N O HO N OH IC50 = 13.0 nM 377.4 O=C(CCc1cc2n(n1)-c1ccc(O)cc1CC2)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1772682 single protein format
CHEMBL1084332 OBDepict O NH CH 3 N N H H 3 C O OH N HO IC50 = 14.0 nM 384.44 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC[C@@H](C)C1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1086029 OBDepict O N H O HO N CH 3 N OH IC50 = 14.0 nM 419.48 Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1086108 OBDepict O HN O HO N CH 3 N N OH IC50 = 15.0 nM 366.38 Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085842 OBDepict O HN H 3 C N N O HO N F F F HO IC50 = 15.0 nM 500.48 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cc(F)c(F)c(F)c2)C1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1082294 OBDepict F N N N O H 2 N N H O O HO F F F IC50 = 15.0 nM 505.43 NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1224070 OBDepict Cl O O N N H N O IC50 = 15.0 nM 331.76 O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 Homo sapiens CHEMBL1225925 single protein format
CHEMBL4073322 OBDepict O N H O HO F IC50 = 16.0 nM 313.33 O=C(/C=C/C#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL1085711 OBDepict O HN O HO OH IC50 = 16.0 nM 361.4 O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1772682 single protein format
CHEMBL1083450 OBDepict O N H O OH N OH F IC50 = 16.0 nM 434.47 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL520136 OBDepict O N H N O HO H N OH IC50 = 17.0 nM 377.4 O=C(CCc1[nH]nc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1083451 OBDepict O N H O HO N HO F F F IC50 = 18.0 nM 484.47 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(C(F)(F)F)nc2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL485185 OBDepict O NH O OH N N H IC50 = 18.0 nM 359.39 O=C(CCc1ccc2c(ccc3[nH]ncc32)c1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1083473 OBDepict O HN O HO Cl IC50 = 19.0 nM 379.84 O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1120319 single protein format
CHEMBL1084841 OBDepict O N H O N O OH N N F F F IC50 = 19.0 nM 472.42 O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1208923 OBDepict F F F N H N O OH IC50 = 20.0 nM 282.22 O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)C2 Homo sapiens CHEMBL1211914 single protein format
CHEMBL237036 OBDepict O NH S O OH N N N HO IC50 = 20.0 nM 358.38 O=C(CCc1cnc(-n2cc(O)cn2)s1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL1770357 OBDepict H 3 C N H O OH O NH 2 H O N N N OH IC50 = 20.0 nM 387.4 CC1CCC(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 Homo sapiens CHEMBL1772682 single protein format
CHEMBL1770359 OBDepict O N H O N H H 3 C O OH N N F IC50 = 21.0 nM 374.37 C[C@@H]1CCC(C(=O)O)=C(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)C1 Homo sapiens CHEMBL1772682 single protein format
CHEMBL1084448 OBDepict O NH CH 3 N N O OH N HO IC50 = 22.0 nM 370.41 CC(Cc1cnn(-c2ccc(O)cn2)c1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1088213 OBDepict O HN HO O N N O OH N OH Ki = 22.0 nM 374.35 O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL485327 OBDepict O NH N O OH N S OH IC50 = 23.0 nM 371.42 O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCC1 Homo sapiens CHEMBL971523 cell-based format
CHEMBL3589834 OBDepict O NH O OH F HO IC50 = 23.0 nM 379.39 O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL3591334 cell-based format
CHEMBL522649 OBDepict O NH O OH HO IC50 = 24.0 nM 335.36 O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL983496 cell-based format
CHEMBL4647392 OBDepict O NH O OH Cl HO IC50 = 24.0 nM 369.8 O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL4618010 cell-based format
CHEMBL236163 OBDepict O HN O HO N CH 3 N OH IC50 = 24.0 nM 365.39 Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 Homo sapiens CHEMBL900196 single protein format
CHEMBL4065654 OBDepict O N H O HO HO IC50 = 25.0 nM 311.34 O=C(/C=C/C#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL1085875 OBDepict O NH CH 3 N N O OH N HO IC50 = 25.0 nM 366.38 CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085402 OBDepict O N H CH 3 N H 3 C N O HO HO IC50 = 26.0 nM 383.45 Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cc1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL1085150 OBDepict O N H O HO N N N HO IC50 = 26.0 nM 356.38 O=C(CCc1cnn(-c2ccc(O)cn2)c1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1120319 single protein format
CHEMBL237037 OBDepict O NH S O OH N N HO IC50 = 26.0 nM 369.4 O=C(CCc1cnc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL900196 single protein format
CHEMBL4060899 OBDepict O N H O HO F HO IC50 = 28.0 nM 331.34 O=C(CCC#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL1083743 OBDepict F N N N O NH 2 N H O O OH F F IC50 = 28.0 nM 487.44 NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1084393 OBDepict O N H CH 3 O N N O HO N HO Ki = 29.0 nM 372.38 CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 Homo sapiens CHEMBL1105987 cell-based format
CHEMBL520620 OBDepict O NH N O OH N S IC50 = 31.0 nM 365.41 O=C(CCc1cn2c(n1)sc1ccccc12)Nc1ccccc1C(=O)O Homo sapiens CHEMBL971523 cell-based format
CHEMBL1085816 OBDepict O N H NH 2 O N N O HO N F IC50 = 32.0 nM 375.36 NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL4083762 OBDepict O N H O OH OH IC50 = 32.0 nM 365.43 O=C(CCc1ccc(-c2cccc(O)c2)cc1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL1086103 OBDepict O HN O HO N N OH IC50 = 32.0 nM 351.36 O=C(CCc1cnn(-c2ccc(O)cc2)c1)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1120319 single protein format
CHEMBL1224071 OBDepict Cl O O N N H N O IC50 = 33.0 nM 331.76 O=c1[nH]c(OCCCOc2cccc(Cl)c2)nc2ncccc12 Homo sapiens CHEMBL1225925 single protein format
CHEMBL491002 OBDepict O HN O HO NH 2 IC50 = 34.0 nM 334.38 Nc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 Homo sapiens CHEMBL983496 cell-based format
CHEMBL1086355 OBDepict O N H O HO HO IC50 = 34.0 nM 415.49 O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL1085815 OBDepict O N H O N O OH N N F IC50 = 35.0 nM 360.35 O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL482963 OBDepict O N H N O HO CH 3 N OH IC50 = 35.0 nM 391.43 Cn1nc2c(c1CCC(=O)Nc1ccccc1C(=O)O)CCc1cc(O)ccc1-2 Homo sapiens CHEMBL971523 cell-based format
CHEMBL1086031 OBDepict O N H O HO F N HO IC50 = 36.0 nM 460.51 O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 Homo sapiens CHEMBL1119082 cell-based format
CHEMBL4069406 OBDepict O N H O HO OH IC50 = 37.0 nM 311.34 O=C(/C=C/C#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL4076822 OBDepict O N H O OH HO IC50 = 40.0 nM 365.43 O=C(CCc1ccc(-c2ccccc2O)cc1)NC1=C(C(=O)O)CCCC1 Homo sapiens CHEMBL4056813 cell-based format
CHEMBL1770176 OBDepict O N H H 2 N H O N N O OH HO IC50 = 41.0 nM 368.35 N[C@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O Homo sapiens CHEMBL1772682 single protein format