HOME LIGAND hPROTEOME OTHERS DOCUMENT

P35354 | PGH2_HUMAN | Prostaglandin G/H synthase 2 (PTGS2)

3D structures mapped by conservation among orthologs

[ Domain: "Heme-dependent peroxidases" // An_peroxidase ]

download pymol session

[ Domain: "EGF/Laminin" // hEGF_4 ]

download pymol session

[ Domain: pdbs with more than 2 multi-domains ]

download pymol session



[ 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
CHEMBL134342 OBDepict OH O H S S IC50 = 0.0 nM 206.33 O=C(O)CCCC[C@@H]1CCSS1 Homo sapiens CHEMBL969894 single protein format
CHEMBL2158361 OBDepict O N O CH 3 O O IC50 = 0.0 nM 287.32 CC(Oc1cc(=O)oc2ccccc12)C(=O)N1CCCC1 Homo sapiens CHEMBL2161532 cell-based format
CHEMBL501676 OBDepict Cl Se N Cl IC50 = 0.0 nM 353.11 Clc1ccc(-c2cn[se]c2-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL969894 single protein format
CHEMBL513405 OBDepict H 3 C N Se Cl IC50 = 0.0 nM 332.69 Cc1ccc(-c2cn[se]c2-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL969894 single protein format
CHEMBL471171 OBDepict H 3 C Se N Cl IC50 = 0.0 nM 332.69 Cc1ccc(-c2[se]ncc2-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL969894 single protein format
CHEMBL452730 OBDepict CH 3 O Se N CH 3 IC50 = 0.0 nM 328.27 COc1ccc(-c2[se]ncc2-c2ccc(C)cc2)cc1 Homo sapiens CHEMBL969894 single protein format
CHEMBL51085 OBDepict O N Se IC50 = 0.0 nM 274.18 O=c1c2ccccc2[se]n1-c1ccccc1 Homo sapiens CHEMBL969894 single protein format
CHEMBL499068 OBDepict H 3 C O N H S O O NH 2 IC50 = 0.006 nM 378.45 COc1ccc(-c2c(-c3ccc(S(N)(=O)=O)cc3)[nH]c3ccccc23)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL525247 OBDepict CH 3 N H S O O NH 2 IC50 = 0.02 nM 362.45 Cc1ccc2[nH]c(-c3ccc(S(N)(=O)=O)cc3)c(-c3ccccc3)c2c1 Homo sapiens CHEMBL997791 single protein format
CHEMBL501208 OBDepict F N H S O O CH 3 IC50 = 0.02 nM 365.43 CS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccc(F)cc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL499069 OBDepict H 3 C O N H S O O CH 3 IC50 = 0.02 nM 377.47 COc1ccc(-c2c(-c3ccc(S(C)(=O)=O)cc3)[nH]c3ccccc23)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL502555 OBDepict H 3 C N H S O O NH 2 IC50 = 0.07 nM 362.45 Cc1ccc(-c2c(-c3ccc(S(N)(=O)=O)cc3)[nH]c3ccccc23)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL143776 OBDepict F N H F IC50 = 0.08 nM 321.37 Fc1ccc(-c2[nH]c(-c3ccc(F)cc3)c3c2C2CCC3C2)cc1 Homo sapiens CHEMBL769655 single protein format
CHEMBL500936 OBDepict H N S O O NH 2 IC50 = 0.09 nM 348.43 NS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL524543 OBDepict H 3 C N H S O O CH 3 IC50 = 0.09 nM 361.47 Cc1ccc(-c2c(-c3ccc(S(C)(=O)=O)cc3)[nH]c3ccccc23)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL140167 OBDepict F N H F IC50 = 0.12 nM 335.4 Fc1ccc(-c2[nH]c(-c3ccc(F)cc3)c3c2C2CCC3CC2)cc1 Homo sapiens CHEMBL769655 single protein format
CHEMBL499349 OBDepict Cl N H S O O NH 2 IC50 = 0.14 nM 382.87 NS(=O)(=O)c1ccc(-c2[nH]c3ccc(Cl)cc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL525021 OBDepict H 3 C CH 3 N H S O O CH 3 IC50 = 0.17 nM 375.49 Cc1ccc(-c2c(-c3ccc(S(C)(=O)=O)cc3)[nH]c3ccccc23)cc1C Homo sapiens CHEMBL997791 single protein format
CHEMBL500943 OBDepict CH 3 HN O S O O N H IC50 = 0.18 nM 390.46 CC(=O)NS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL1958349 OBDepict OH O O H 3 C CH 3 H 3 C IC50 = 0.2 nM 326.44 CC(C)Cc1ccc(C(C)C(=O)Oc2ccc(CCO)cc2)cc1 Homo sapiens CHEMBL1959074 single protein format
CHEMBL551829 OBDepict F F F N N H N S O O CH 3 IC50 = 0.25 nM 407.42 CS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nc(NCc3ccccc3)n2)cc1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL525250 OBDepict CH 3 N H S O O CH 3 IC50 = 0.28 nM 361.47 Cc1ccc2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(-c3ccccc3)c2c1 Homo sapiens CHEMBL997791 single protein format
CHEMBL551148 OBDepict F HN N N F F F S O O CH 3 IC50 = 0.28 nM 425.41 CS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nc(NCc3ccc(F)cc3)n2)cc1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL423296 OBDepict CH 3 O N CH 3 O S N Cl Br IC50 = 0.3 nM 551.89 COc1ccc2c(c1)c(Cc1nc(-c3ccc(Br)cc3)cs1)c(C)n2C(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL769647 cell-based format
CHEMBL271173 OBDepict H 3 C O N N H N S S O O CH 3 IC50 = 0.3 nM 389.5 CCOc1cc(NCc2cccs2)nc(-c2ccc(S(C)(=O)=O)cc2)n1 Homo sapiens CHEMBL947228 tissue-based format
CHEMBL502285 OBDepict Cl N H S O O CH 3 IC50 = 0.36 nM 381.88 CS(=O)(=O)c1ccc(-c2[nH]c3ccc(Cl)cc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL502554 OBDepict Br N H S O O CH 3 IC50 = 0.37 nM 426.34 CS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccc(Br)cc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL270293 OBDepict H 3 C O N N H N S S O O CH 3 IC50 = 0.4 nM 375.48 COc1cc(NCc2cccs2)nc(-c2ccc(S(C)(=O)=O)cc2)n1 Homo sapiens CHEMBL947228 tissue-based format
CHEMBL186632 OBDepict CH 3 O N N N S O O H 2 N IC50 = 0.44 nM 394.46 CCOc1ccc(-c2nn3ncccc3c2-c2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL833052 cell-based format
CHEMBL118 OBDepict H 3 C N N F F F S O O NH 2 Ki = 0.47 nM 381.38 Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL4810382 single protein format
CHEMBL561891 OBDepict F F F N N H N S O O CH 3 IC50 = 0.5 nM 399.44 CS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nc(NC3CCCCC3)n2)cc1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL500674 OBDepict Cl N H Cl S O O NH 2 IC50 = 0.54 nM 417.32 NS(=O)(=O)c1ccc(-c2[nH]c3ccc(Cl)cc3c2-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL499070 OBDepict H N S O O CH 3 IC50 = 0.6 nM 347.44 CS(=O)(=O)c1ccc(-c2[nH]c3ccccc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL500675 OBDepict Cl N H Cl S O O CH 3 IC50 = 0.8 nM 416.33 CS(=O)(=O)c1ccc(-c2[nH]c3ccc(Cl)cc3c2-c2cccc(Cl)c2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL327384 OBDepict Cl S O O CH 3 IC50 = 1.0 nM 358.89 CS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL330314 OBDepict F F F S O O NH 2 IC50 = 1.0 nM 393.43 NS(=O)(=O)c1ccc(C2=C(c3ccc(C(F)(F)F)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL432945 OBDepict H 3 C O S O O NH 2 IC50 = 1.0 nM 355.46 COc1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL28155 OBDepict CH 3 O N CH 3 O S N Cl S IC50 = 1.0 nM 529.09 COc1ccc2c(c1)c(Cc1nc(-c3csc4ccccc34)cs1)c(C)n2C(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL769647 cell-based format
CHEMBL88717 OBDepict Cl S O O NH 2 IC50 = 1.0 nM 359.88 NS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL313387 OBDepict Cl Cl S O O NH 2 IC50 = 1.0 nM 394.32 NS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)c(Cl)c3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL4851853 OBDepict CH 3 N N H 3 C S O O O IC50 = 1.1 nM 328.39 Cc1ccc(-c2cc(C)n(S(=O)(=O)Oc3ccccc3)n2)cc1 Homo sapiens CHEMBL4810974 single protein format
CHEMBL92154 OBDepict F S O O CH 3 IC50 = 1.1 nM 342.44 CS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL763346 cell-based format
CHEMBL272433 OBDepict H 3 C S N N H N S S O O CH 3 IC50 = 1.2 nM 405.57 CCSc1cc(NCc2cccs2)nc(-c2ccc(S(C)(=O)=O)cc2)n1 Homo sapiens CHEMBL947228 tissue-based format
CHEMBL91118 OBDepict CH 2 S O O CH 3 IC50 = 1.2 nM 296.39 C=C1CC(c2ccc(S(C)(=O)=O)cc2)=C1c1ccccc1 Homo sapiens CHEMBL763346 cell-based format
CHEMBL270078 OBDepict Cl N HN N S S O O CH 3 IC50 = 1.2 nM 379.89 CS(=O)(=O)c1ccc(-c2nc(Cl)cc(NCc3cccs3)n2)cc1 Homo sapiens CHEMBL947228 tissue-based format
CHEMBL93372 OBDepict H 3 C O O O O S O O CH 3 IC50 = 1.26 nM 372.4 CC(=O)Oc1ccc(C2=C(c3ccc(S(C)(=O)=O)cc3)COC2=O)cc1 Homo sapiens CHEMBL763090 single protein format
CHEMBL3314084 OBDepict O N Cl Cl O O IC50 = 1.3 nM 434.28 O=C1/C(=C/c2coc3ccccc3c2=O)c2ccccc2N1c1c(Cl)cccc1Cl Homo sapiens CHEMBL3380375 single protein format
CHEMBL549393 OBDepict H 3 C NH N N F F F S O O CH 3 IC50 = 1.3 nM 373.4 CCCCNc1nc(-c2ccc(S(C)(=O)=O)cc2)cc(C(F)(F)F)n1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL538418 OBDepict H 3 C NH N N F F F S O O NH 2 IC50 < 1.4 nM 374.39 CCCCNc1nc(-c2ccc(S(N)(=O)=O)cc2)cc(C(F)(F)F)n1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL527107 OBDepict Br N H S O O CH 3 IC50 = 1.41 nM 426.34 CS(=O)(=O)c1ccc(-c2[nH]c3ccc(Br)cc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL502556 OBDepict H 3 C CH 3 N H S O O NH 2 IC50 = 1.46 nM 376.48 Cc1ccc(-c2c(-c3ccc(S(N)(=O)=O)cc3)[nH]c3ccccc23)cc1C Homo sapiens CHEMBL997791 single protein format
CHEMBL312822 OBDepict F Cl S O O NH 2 IC50 = 1.5 nM 377.87 NS(=O)(=O)c1ccc(C2=C(c3ccc(F)c(Cl)c3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL92102 OBDepict H 3 C S O O CH 3 IC50 = 1.5 nM 338.47 Cc1ccc(C2=C(c3ccc(S(C)(=O)=O)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL93024 OBDepict CH 3 O O O O S O O CH 3 IC50 = 1.68 nM 372.4 CC(=O)Oc1cccc(C2=C(c3ccc(S(C)(=O)=O)cc3)COC2=O)c1 Homo sapiens CHEMBL763090 single protein format
CHEMBL29766 OBDepict F N N F F F S O O NH 2 IC50 = 1.7 nM 385.34 NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)c(F)c2-c2ccccc2)cc1 Homo sapiens CHEMBL769648 single protein format
CHEMBL214101 OBDepict H N N N N O O IC50 = 1.8 nM 304.31 O=C1OCC(c2ccc(-c3nn[nH]n3)cc2)=C1c1ccccc1 Homo sapiens CHEMBL869874 single protein format
CHEMBL213338 OBDepict CH 3 N N F F F N N N N H IC50 = 1.9 nM 370.34 Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(-c3nn[nH]n3)cc2)cc1 Homo sapiens CHEMBL869874 single protein format
CHEMBL499348 OBDepict F N H S O O NH 2 IC50 = 2.0 nM 366.42 NS(=O)(=O)c1ccc(-c2[nH]c3ccc(F)cc3c2-c2ccccc2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL88532 OBDepict H 3 C O F S O O NH 2 IC50 = 2.0 nM 373.45 COc1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CC3(CC3)C2)cc1F Homo sapiens CHEMBL768965 single protein format
CHEMBL371477 OBDepict F O N S O O NH 2 IC50 = 2.0 nM 332.36 NS(=O)(=O)c1ccc(-c2c(-c3ccccc3)noc2CF)cc1 Homo sapiens CHEMBL881226 single protein format
CHEMBL315585 OBDepict H 3 C O Cl S O O NH 2 IC50 = 2.0 nM 389.9 COc1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CC3(CC3)C2)cc1Cl Homo sapiens CHEMBL768965 single protein format
CHEMBL313313 OBDepict H 3 C O Br S O O NH 2 IC50 = 2.0 nM 434.36 COc1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CC3(CC3)C2)cc1Br Homo sapiens CHEMBL768965 single protein format
CHEMBL419407 OBDepict Cl Cl N Cl N S O O NH 2 IC50 = 2.0 nM 402.69 NS(=O)(=O)c1ccc(-n2cnc(Cl)c2-c2cc(Cl)cc(Cl)c2)cc1 Homo sapiens CHEMBL762914 cell-based format
CHEMBL365865 OBDepict CH 3 S O O N N N IC50 = 2.0 nM 349.42 CS(=O)(=O)c1ccc(-c2c(-c3ccccc3)nn3ncccc23)cc1 Homo sapiens CHEMBL833052 cell-based format
CHEMBL329999 OBDepict F F F S O O CH 3 IC50 = 2.0 nM 392.44 CS(=O)(=O)c1ccc(C2=C(c3ccc(C(F)(F)F)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL424063 OBDepict NH 2 S O O O O IC50 = 2.0 nM 343.4 NS(=O)(=O)c1ccc(C2=C(c3ccc4c(c3)OCO4)CCC2)cc1 Homo sapiens CHEMBL760088 single protein format
CHEMBL1939677 OBDepict H 3 C O N CH 3 O O S O O CH 3 O + N O _ O IC50 = 2.0 nM 502.55 COc1ccc(-n2c(-c3ccc(S(C)(=O)=O)cc3)cc(CC(=O)OCCCO[N+](=O)[O-])c2C)cc1 Homo sapiens CHEMBL3887378 assay format
CHEMBL52820 OBDepict F F Cl F S O O NH 2 IC50 = 2.0 nM 397.8 NS(=O)(=O)c1ccc(-c2cc(F)c(F)cc2-c2ccc(F)c(Cl)c2)cc1 Homo sapiens CHEMBL762917 single protein format
CHEMBL111321 OBDepict Cl Cl S O O NH 2 IC50 = 2.0 nM 368.29 NS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)c(Cl)c3)CCC2)cc1 Homo sapiens CHEMBL760088 single protein format
CHEMBL52020 OBDepict F F CH 3 F S O O NH 2 IC50 = 2.0 nM 377.39 Cc1cc(-c2cc(F)c(F)cc2-c2ccc(S(N)(=O)=O)cc2)ccc1F Homo sapiens CHEMBL762917 single protein format
CHEMBL171335 OBDepict F S O O NH 2 IC50 = 2.0 nM 357.45 NS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC3(CCC3)C2)cc1 Homo sapiens CHEMBL764081 single protein format
CHEMBL111562 OBDepict CH 3 O S O O NH 2 IC50 = 2.0 nM 329.42 COc1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CCC2)cc1 Homo sapiens CHEMBL760088 single protein format
CHEMBL111356 OBDepict H 3 C N CH 3 Cl S O O NH 2 IC50 = 2.0 nM 376.91 CN(C)c1ccc(C2=C(c3ccc(S(N)(=O)=O)cc3)CCC2)cc1Cl Homo sapiens CHEMBL760088 single protein format
CHEMBL324312 OBDepict CH 3 O N Cl N S O O NH 2 IC50 = 2.0 nM 377.85 CCOc1ccc(-c2c(Cl)ncn2-c2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL762914 cell-based format
CHEMBL42485 OBDepict F S Br S O O CH 3 IC50 = 2.1 nM 411.32 CS(=O)(=O)c1ccc(-c2cc(Br)sc2-c2ccc(F)cc2)cc1 Homo sapiens CHEMBL763346 cell-based format
CHEMBL92443 OBDepict CH 2 CH 3 H 3 C S O O CH 3 IC50 = 2.2 nM 324.44 C=C1C(c2ccccc2)=C(c2ccc(S(C)(=O)=O)cc2)C1(C)C Homo sapiens CHEMBL763346 cell-based format
CHEMBL271549 OBDepict H 3 C O O N N H N S S O O CH 3 IC50 = 2.4 nM 419.53 COCCOc1cc(NCc2cccs2)nc(-c2ccc(S(C)(=O)=O)cc2)n1 Homo sapiens CHEMBL947228 tissue-based format
CHEMBL561609 OBDepict F F F N N H N S O O NH 2 IC50 = 2.4 nM 400.43 NS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nc(NC3CCCCC3)n2)cc1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL88549 OBDepict CH 3 S O O O O IC50 = 2.5 nM 368.45 CS(=O)(=O)c1ccc(C2=C(c3ccc4c(c3)OCO4)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL89429 OBDepict F S O O CH 3 IC50 = 2.6 nM 340.42 CS(=O)(=O)c1ccc(C2=CC3(C=C2c2ccc(F)cc2)CC3)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL420987 OBDepict O H 3 C CH 3 S O O CH 3 IC50 = 2.8 nM 326.42 CC1(C)C(=O)C(c2ccccc2)=C1c1ccc(S(C)(=O)=O)cc1 Homo sapiens CHEMBL763346 cell-based format
CHEMBL4870569 OBDepict H 3 C O N O HO HO S O O CH 3 Ki = 3.0 nM 435.54 CCCCOc1nc(OCC2(O)CCC2)c(-c2ccc(S(C)(=O)=O)cc2)cc1CO Homo sapiens CHEMBL4810382 single protein format
CHEMBL332251 OBDepict H 3 C N Cl N S O O NH 2 IC50 = 3.0 nM 347.83 Cc1ccc(-c2c(Cl)ncn2-c2ccc(S(N)(=O)=O)cc2)cc1 Homo sapiens CHEMBL762914 cell-based format
CHEMBL1288533 OBDepict HO O O F F F Cl Cl IC50 = 3.0 nM 313.06 O=C(O)C1=Cc2c(ccc(Cl)c2Cl)OC1C(F)(F)F Homo sapiens CHEMBL1291683 single protein format
CHEMBL559613 OBDepict CH 3 N H 3 C N N F F F S O O CH 3 IC50 = 3.0 nM 421.44 Cc1ccc(N(C)c2nc(-c3ccc(S(C)(=O)=O)cc3)cc(C(F)(F)F)n2)cc1 Homo sapiens CHEMBL1059941 cell-based format
CHEMBL55805 OBDepict F F CH 3 Cl S O O NH 2 IC50 = 3.0 nM 393.84 Cc1cc(-c2cc(F)c(F)cc2-c2ccc(S(N)(=O)=O)cc2)ccc1Cl Homo sapiens CHEMBL762917 single protein format
CHEMBL127674 OBDepict H 3 C S O O CH 3 IC50 = 3.0 nM 312.43 Cc1ccc(C2=C(c3ccc(S(C)(=O)=O)cc3)CCC2)cc1 Homo sapiens CHEMBL769653 single protein format
CHEMBL340573 OBDepict Cl S O O CH 3 IC50 = 3.0 nM 332.85 CS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)cc3)CCC2)cc1 Homo sapiens CHEMBL769653 single protein format
CHEMBL155898 OBDepict O N N O S O O CH 3 IC50 = 3.0 nM 410.5 CS(=O)(=O)c1ccc(-c2cnn(Cc3ccccc3)c(=O)c2OCC2CC2)cc1 Homo sapiens CHEMBL763938 cell-based format
CHEMBL298476 OBDepict H 3 C Cl N N F F F S O O NH 2 IC50 = 3.0 nM 415.82 Cc1ccc(-c2nc(C(F)(F)F)cn2-c2ccc(S(N)(=O)=O)cc2)cc1Cl Homo sapiens CHEMBL762906 single protein format
CHEMBL111590 OBDepict Cl S O O NH 2 IC50 = 3.0 nM 333.84 NS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)cc3)CCC2)cc1 Homo sapiens CHEMBL760088 single protein format
CHEMBL17184 OBDepict F S O O NH 2 IC50 = 3.0 nM 343.42 NS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL558340 OBDepict Cl Cl S O O CH 3 IC50 = 3.0 nM 393.33 CS(=O)(=O)c1ccc(C2=C(c3ccc(Cl)c(Cl)c3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL54327 OBDepict F F Cl H 3 C S O O NH 2 IC50 = 3.0 nM 393.84 Cc1ccc(-c2cc(F)c(F)cc2-c2ccc(S(N)(=O)=O)cc2)cc1Cl Homo sapiens CHEMBL762917 single protein format
CHEMBL156482 OBDepict F F F N N N S S O O H 3 C IC50 = 3.0 nM 423.44 CS(=O)(=O)c1ccc(-c2sc3nc(C(F)(F)F)nn3c2-c2ccccc2)cc1 Homo sapiens CHEMBL769656 cell-based format
CHEMBL421826 OBDepict H 3 C N S N N F F F S O O H 3 C IC50 = 3.0 nM 437.47 Cc1cccc(-c2c(-c3ccc(S(C)(=O)=O)cc3)sc3nc(C(F)(F)F)nn23)c1 Homo sapiens CHEMBL769656 cell-based format
CHEMBL364804 OBDepict CH 3 O N N N S O O H 3 C IC50 = 3.0 nM 393.47 CCOc1ccc(-c2nn3ncccc3c2-c2ccc(S(C)(=O)=O)cc2)cc1 Homo sapiens CHEMBL833052 cell-based format
CHEMBL314225 OBDepict F F S O O NH 2 IC50 = 3.0 nM 361.41 NS(=O)(=O)c1ccc(C2=C(c3ccc(F)c(F)c3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format
CHEMBL524542 OBDepict Cl N H Cl S O O NH 2 IC50 = 3.13 nM 417.32 NS(=O)(=O)c1ccc(-c2[nH]c3ccc(Cl)cc3c2-c2cccc(Cl)c2)cc1 Homo sapiens CHEMBL997791 single protein format
CHEMBL92107 OBDepict F F S O O CH 3 IC50 = 3.3 nM 360.43 CS(=O)(=O)c1ccc(C2=C(c3ccc(F)c(F)c3)CC3(CC3)C2)cc1 Homo sapiens CHEMBL768965 single protein format