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P06737 | PYGL_HUMAN | "Glycogen phosphorylase, liver form" (PYGL)

3D structures mapped by conservation among orthologs

[ Domain: "UDP-Glycosyltransferase/glycogen phosphorylase" // Phosphorylase_C ]

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[ Domain: "UDP-Glycosyltransferase/glycogen phosphorylase" // Phosphorylase_N ]

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

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[ 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
CHEMBL133911 OBDepict F N H O O N + N O _ O O HO O OH IC50 = 1.0 nM 441.33 O=C(Nc1c(F)cccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL134802 OBDepict O N H N + N O O _ O O HO O HO IC50 = 1.0 nM 473.4 O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL115651 OBDepict CH 3 O H 3 C O CH 3 N O OH Cl O OH Cl IC50 = 2.0 nM 504.37 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccc(Cl)cc1 Homo sapiens CHEMBL712595 assay format
CHEMBL133832 OBDepict Cl N N H O O O HO O HO IC50 = 2.0 nM 462.85 O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL440528 OBDepict CH 3 O N N H O O O OH O HO IC50 = 2.0 nM 458.43 COc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL394526 OBDepict HO HO H N O N H O N H S Cl Cl IC50 = 2.0 nM 454.33 O=C(NC1Cc2ccccc2N(C[C@@H](O)CO)C1=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL132191 OBDepict O N H N + N O O _ O O HO O HO IC50 = 3.0 nM 423.34 O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL471266 OBDepict CH 3 O HN NH O HN O H O H 3 C H O HO CH 3 H 3 C CH 3 CH 3 H 3 C CH 3 IC50 = 3.0 nM 561.68 COc1ccc(-c2ccc(C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(NC(=O)Nc3c(C)cc(C)cc3C)c2)cc1 Homo sapiens CHEMBL1027304 assay format
CHEMBL458655 OBDepict O N H N H CH 3 H 3 C HN O H F O CH 3 H O OH H 3 C CH 3 H 3 C IC50 = 3.0 nM 589.71 Cc1cc(CC2CC2)cc(C)c1NC(=O)Nc1cc(-c2cccc(F)c2)ccc1C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C Homo sapiens CHEMBL1027304 assay format
CHEMBL133274 OBDepict CH 3 N N H O O O OH O HO IC50 = 4.0 nM 456.45 CCc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL459792 OBDepict O N H N H CH 3 CH 3 F NH O H O CH 3 H O HO CH 3 CH 3 CH 3 IC50 = 4.0 nM 513.61 Cc1cc(CC2CC2)cc(C)c1NC(=O)Nc1cc(F)ccc1C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C Homo sapiens CHEMBL1027304 assay format
CHEMBL506011 OBDepict H 3 C CH 3 H 3 C N H N H O HN O H O CH 3 H O OH O H 3 C H 3 C CH 3 H 3 C IC50 = 4.0 nM 589.73 CCCc1cc(C)c(NC(=O)Nc2cc(-c3ccc(OC)cc3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL449986 OBDepict CH 3 CH 3 CH 3 N H N H O NH O H F O CH 3 H O HO CH 3 CH 3 CH 3 IC50 = 4.0 nM 577.7 CCCc1cc(C)c(NC(=O)Nc2cc(-c3cccc(F)c3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL115341 OBDepict CH 3 O O CH 3 N CH 3 O HO O O O HO H 3 C CH 3 Cl IC50 = 4.0 nM 529.97 COc1ccc(CN2C(C)=C(C(=O)OC(C)C)C(c3ccccc3Cl)C(C(=O)O)=C2C(=O)O)cc1OC Homo sapiens CHEMBL712595 assay format
CHEMBL217994 OBDepict O N N H H H 3 C CH 3 O N H S Cl Cl IC50 = 5.0 nM 410.33 CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL480195 OBDepict O NH N H Cl Cl HN O O H F F F O OH IC50 = 5.0 nM 598.41 O=C(Nc1cc2ccccc2cc1C(=O)N[C@H](C(=O)O)C1CCCCC1)Nc1c(Cl)cc(OC(F)(F)F)cc1Cl Homo sapiens CHEMBL1034792 assay format
CHEMBL423509 OBDepict CH 3 O H 3 C O CH 3 N O OH Cl O OH + N O _ O IC50 = 5.0 nM 514.92 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cccc([N+](=O)[O-])c1 Homo sapiens CHEMBL712595 assay format
CHEMBL481534 OBDepict O HN HN CH 3 H 3 C N H O CH 3 O OH IC50 = 5.0 nM 501.63 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)NC2(C(=O)O)CCCCCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL434025 OBDepict Cl N H N H O O O N H O N H Cl IC50 = 6.0 nM 503.39 O=C(NCCOCCOCCNC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL3378175 single protein format
CHEMBL472140 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H O HO IC50 = 6.0 nM 487.6 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)C2CCCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL473851 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H O CH 3 H O HO CH 3 CH 3 CH 3 IC50 = 7.0 nM 505.62 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1034807 assay format
CHEMBL395733 OBDepict OH N O N H O N H S Cl Cl IC50 = 7.0 nM 424.31 O=C(NC1Cc2ccccc2N(CCO)C1=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL472292 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H O CH 3 H O HO F CH 3 CH 3 CH 3 IC50 = 7.0 nM 549.64 Cc1cc(C)c(NC(=O)Nc2cc(-c3ccc(F)cc3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL443938 OBDepict H 3 C CH 3 H 3 C N H N H O HN O H F O CH 3 H O OH F H 3 C CH 3 H 3 C IC50 = 7.0 nM 595.69 CCCc1cc(C)c(NC(=O)Nc2cc(-c3ccc(F)c(F)c3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL113736 OBDepict CH 3 N CH 3 O OH N H O O HO Cl CH 3 H 3 C IC50 = 7.88 nM 420.89 CCN1C(C)=C(C(=O)NCC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C1C(=O)O Homo sapiens CHEMBL712595 assay format
CHEMBL113762 OBDepict Cl N CH 3 O HO O O O HO H 3 C CH 3 Cl IC50 = 8.0 nM 504.37 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cccc(Cl)c1 Homo sapiens CHEMBL712595 assay format
CHEMBL479920 OBDepict CH 3 O N H N H O HN O H O H 3 C H O OH CH 3 H 3 C CH 3 CH 3 CH 3 CH 3 IC50 = 8.0 nM 561.68 COc1cccc(-c2ccc(C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(NC(=O)Nc3c(C)cc(C)cc3C)c2)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL219059 OBDepict O N H N H H S H HO Cl Cl IC50 = 9.0 nM 367.26 O=C(N[C@@H]1Cc2ccccc2[C@H]1O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL114226 OBDepict CH 3 N CH 3 O OH N H O O HO H 3 C CH 3 Cl IC50 = 9.1 nM 406.87 CCN1C(C)=C(C(=O)NC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C1C(=O)O Homo sapiens CHEMBL712595 assay format
CHEMBL133923 OBDepict CH 3 N N H O O O OH O HO IC50 = 10.0 nM 442.43 Cc1ccnc(C(=O)Nc2cc3ccccc3cc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL132640 OBDepict Cl N N H O F O O HO O HO IC50 = 10.0 nM 430.77 O=C(Nc1c(F)cccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL482146 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H 3 C O HO IC50 = 10.0 nM 501.63 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@](C)(C(=O)O)C2CCCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL473486 OBDepict H 3 C CH 3 H 3 C N H N H O F HN O H O CH 3 H O OH H 3 C CH 3 H 3 C IC50 = 10.0 nM 501.6 CCCc1cc(C)c(NC(=O)Nc2cc(F)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL471469 OBDepict O HN HN CH 3 H 3 C N H O CH 3 H O H 3 C H O OH H 3 C H 3 C CH 3 IC50 = 10.0 nM 531.65 Cc1cc(C)c(NC(=O)Nc2cc(-c3ccccc3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL326950 OBDepict CH 3 N CH 3 O HO HN O O HO Cl IC50 = 10.9 nM 454.91 CCN1C(C)=C(C(=O)NCc2ccccc2)C(c2ccccc2Cl)C(C(=O)O)=C1C(=O)O Homo sapiens CHEMBL712595 assay format
CHEMBL133603 OBDepict H 3 C O N HN O F O O OH O OH IC50 = 11.0 nM 426.36 COc1ccnc(C(=O)Nc2c(F)cccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL114731 OBDepict CH 3 O H 3 C O CH 3 N O OH Cl O OH IC50 = 11.0 nM 469.92 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccccc1 Homo sapiens CHEMBL712595 assay format
CHEMBL396724 OBDepict HO OH H N O H N H O N H S Cl IC50 = 12.0 nM 419.89 O=C(N[C@H]1Cc2ccccc2N(C[C@H](O)CO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL179485 OBDepict HO N O N H S O O O N H Cl IC50 = 12.0 nM 427.91 O=C(NCC(=O)N(CCO)C1CCS(=O)(=O)CC1)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL826961 single protein format
CHEMBL337224 OBDepict O N H N O F F F O HO O HO IC50 = 12.0 nM 496.4 O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(C(F)(F)F)ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL114846 OBDepict CH 3 NH O CH 3 N CH 3 O OH Cl O OH IC50 = 12.4 nM 392.84 CCNC(=O)C1=C(C)N(CC)C(C(=O)O)=C(C(=O)O)C1c1ccccc1Cl Homo sapiens CHEMBL712595 assay format
CHEMBL512725 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H F O CH 3 H O HO F CH 3 CH 3 CH 3 IC50 = 13.0 nM 567.63 Cc1cc(C)c(NC(=O)Nc2cc(-c3ccc(F)c(F)c3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL334272 OBDepict CH 3 O H 3 C O CH 3 N O OH Cl O OH Cl Cl IC50 = 13.0 nM 538.81 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL712595 assay format
CHEMBL474098 OBDepict O HN N H H 3 C CH 3 F NH O H O HO IC50 = 13.0 nM 495.6 Cc1cc(CC2CC2)cc(C)c1NC(=O)Nc1cc(F)ccc1C(=O)N[C@H](C(=O)O)C1CCCCC1 Homo sapiens CHEMBL1027304 assay format
CHEMBL519796 OBDepict CH 3 H 3 C CH 3 NH NH O N H O O HO F F IC50 = 13.0 nM 523.58 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)NC(C(=O)O)C2CCC(F)(F)CC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL133114 OBDepict F N H O O N + N O HO O _ O O HO IC50 = 13.0 nM 441.33 O=C(Nc1cc(F)ccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL481535 OBDepict CH 3 CH 3 H 3 C HN HN O N H O O OH IC50 = 14.0 nM 529.68 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)NC2(C(=O)O)CCCCCCCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL513400 OBDepict O N H N H CH 3 H 3 C HN O CH 3 H O OH IC50 = 14.0 nM 473.57 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)C2CCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL479728 OBDepict O N H N H H 3 C CH 3 NH O CH 3 H F O CH 3 H O HO CH 3 CH 3 CH 3 IC50 = 15.0 nM 549.64 Cc1cc(C)c(NC(=O)Nc2cc(-c3cccc(F)c3)ccc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL115441 OBDepict Cl Cl N CH 3 O HO O O O HO H 3 C CH 3 Cl IC50 = 15.0 nM 538.81 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1Cc1cc(Cl)cc(Cl)c1 Homo sapiens CHEMBL712595 assay format
CHEMBL132201 OBDepict N N HN O O O OH O OH IC50 = 16.0 nM 403.35 N#Cc1ccnc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL475217 OBDepict O NH N H H 3 C CH 3 HN O CH 3 H O CH 3 H O OH IC50 = 16.0 nM 539.63 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)[C@@H](C)OCc2ccccc2)c(C)c1 Homo sapiens CHEMBL1034807 assay format
CHEMBL180776 OBDepict H 3 C OH N O N H O N H Cl IC50 = 16.0 nM 377.87 CC(O)CN(C(=O)CNC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCCC1 Homo sapiens CHEMBL826961 single protein format
CHEMBL134152 OBDepict Cl N N H O O O HO O HO IC50 = 17.0 nM 412.79 O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(Cl)ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL473850 OBDepict CH 3 O CH 3 H 3 C H HN H O HO O N H N H O CH 3 H 3 C CH 3 IC50 = 17.0 nM 491.59 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)C)c(C)c1 Homo sapiens CHEMBL1034807 assay format
CHEMBL1084328 OBDepict H 3 C O H O OH H N H O N H S Cl Cl IC50 = 17.0 nM 467.37 COCCC(C(=O)O)[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL233656 OBDepict OH N O N H O N H Cl IC50 = 17.0 nM 383.83 O=C(NC1Cc2ccccc2N(CCO)C1=O)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL218714 OBDepict O N N H H H 3 C CH 3 O N H S Cl IC50 = 17.0 nM 375.88 CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL473852 OBDepict CH 3 H 3 C H 3 C HN HN O N H O H O CH 3 H O HO IC50 = 17.0 nM 503.6 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@H](C(=O)O)[C@@H](C)OC2CCC2)c(C)c1 Homo sapiens CHEMBL1034807 assay format
CHEMBL1084762 OBDepict OH O H H N H O N H S Cl Cl IC50 = 18.0 nM 409.29 O=C(O)C[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL474297 OBDepict H 3 C CH 3 CH 3 N H N H O F NH O H O HO IC50 = 19.0 nM 483.58 CCCc1cc(C)c(NC(=O)Nc2cc(F)ccc2C(=O)N[C@H](C(=O)O)C2CCCCC2)c(C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL458289 OBDepict Cl N H N H O F F H OH F F IC50 = 20.0 nM 412.77 O=C(Nc1c(F)cc2c(c1F)CCC(F)(F)[C@@H]2O)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL990750 assay format
CHEMBL131644 OBDepict H 3 C O N NH O O O HO O HO IC50 = 20.0 nM 408.37 COc1ccnc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1 Homo sapiens CHEMBL680561 assay format
CHEMBL234950 OBDepict OH N O N H O N H S Cl IC50 = 21.0 nM 403.89 O=C(NC1Cc2ccccc2N(CCCO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL231836 OBDepict HO OH H N O H N H O N H S Cl IC50 = 21.0 nM 419.89 O=C(N[C@@H]1Cc2ccccc2N(C[C@H](O)CO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL198408 OBDepict CH 3 O NH HO N H O O Cl F IC50 = 23.0 nM 338.72 COc1ccc(O)cc1NC(=O)NC(=O)c1ccc(F)cc1Cl Homo sapiens CHEMBL883911 assay format
CHEMBL482147 OBDepict CH 3 HN H O HO O N H N H O CH 3 CH 3 H 3 C IC50 = 23.0 nM 461.56 CCCC[C@H](NC(=O)c1cc2ccccc2cc1NC(=O)Nc1c(C)cc(C)cc1C)C(=O)O Homo sapiens CHEMBL1034807 assay format
CHEMBL442404 OBDepict O N H + N O O _ O O HO O HO IC50 = 23.0 nM 472.41 O=C(Nc1cc2ccccc2cc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cccc([N+](=O)[O-])c1 Homo sapiens CHEMBL680561 assay format
CHEMBL217993 OBDepict O N N H H H 3 C CH 3 O N H S Br Br IC50 = 23.0 nM 499.23 CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2sc(Br)c(Br)c2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL475378 OBDepict H 3 C O H HN H O HO O N H N H O CH 3 CH 3 H 3 C IC50 = 24.0 nM 553.66 CC[C@@H](OCc1ccccc1)[C@H](NC(=O)c1cc2ccccc2cc1NC(=O)Nc1c(C)cc(C)cc1C)C(=O)O Homo sapiens CHEMBL1034807 assay format
CHEMBL139472 OBDepict O N H H N H O N H Cl IC50 = 25.0 nM 339.78 O=C(N[C@@H]1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL712594 assay format
CHEMBL337332 OBDepict Cl N H N H O O N CH 3 IC50 = 25.0 nM 353.81 CN1C(=O)C(NC(=O)c2cc3cc(Cl)ccc3[nH]2)Cc2ccccc21 Homo sapiens CHEMBL712594 assay format
CHEMBL475639 OBDepict O N H N H CH 3 CH 3 HN O H 3 C H O HO CH 3 CH 3 H 3 C IC50 = 25.0 nM 489.62 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)N[C@@H](CCC(C)(C)C)C(=O)O)c(C)c1 Homo sapiens CHEMBL1034807 assay format
CHEMBL3770455 OBDepict HO H O H OH H H OH N N H HO H Ki = 26.0 nM 356.38 OC[C@H]1O[C@@H](c2nc(-c3ccc4ccccc4c3)c[nH]2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3873254 tissue-based format
CHEMBL233447 OBDepict HO N O N H O N H S Cl IC50 = 26.0 nM 389.86 O=C(NC1Cc2ccccc2N(CCO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL520765 OBDepict CH 3 H 3 C CH 3 NH NH O N H O O HO IC50 = 27.0 nM 521.62 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)NC2(C(=O)O)CCc3ccccc3C2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL231835 OBDepict HO OH H N O H N H O N H S Cl IC50 = 27.0 nM 419.89 O=C(N[C@H]1Cc2ccccc2N(C[C@@H](O)CO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL233446 OBDepict N N O N H O N H S Cl IC50 = 28.0 nM 384.85 N#CCN1C(=O)C(NC(=O)c2cc3cc(Cl)sc3[nH]2)Cc2ccccc21 Homo sapiens CHEMBL889956 single protein format
CHEMBL516918 OBDepict CH 3 O HN NH O N H O H O H 3 C H O HO CH 3 CH 3 CH 3 H 3 C CH 3 H 3 C IC50 = 28.0 nM 561.68 COc1ccccc1-c1ccc(C(=O)N[C@H](C(=O)O)[C@@H](C)OC(C)(C)C)c(NC(=O)Nc2c(C)cc(C)cc2C)c1 Homo sapiens CHEMBL1027304 assay format
CHEMBL234951 OBDepict HO HO H N O N H O N H S Cl IC50 = 29.0 nM 419.89 O=C(NC1Cc2ccccc2N(C[C@@H](O)CO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL433766 OBDepict N N O N H O N H Cl IC50 = 30.0 nM 358.83 N#CCN(C(=O)CNC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCCC1 Homo sapiens CHEMBL826961 single protein format
CHEMBL425526 OBDepict HO N O N H O N H Cl IC50 = 30.0 nM 391.9 O=C(NCC(=O)N(CCO)C1CCCCCC1)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL826961 single protein format
CHEMBL1083642 OBDepict HO O O H H N H O N H S Cl Cl IC50 = 30.0 nM 425.29 O=C(O)CO[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL134793 OBDepict Br N H N H O O N CH 3 IC50 = 30.0 nM 398.26 CN1C(=O)C(NC(=O)c2cc3cc(Br)ccc3[nH]2)Cc2ccccc21 Homo sapiens CHEMBL712594 assay format
CHEMBL217903 OBDepict O N N H H H 3 C CH 3 O N H S Br IC50 = 31.0 nM 420.33 CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(Br)sc2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL181072 OBDepict OH N O N H O N H Cl IC50 = 32.0 nM 405.93 O=C(NCC(=O)N(CCO)C1CCCCCCC1)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL826961 single protein format
CHEMBL481363 OBDepict O N H N H CH 3 CH 3 HN O H 3 C O OH IC50 = 36.0 nM 487.6 Cc1cc(C)c(NC(=O)Nc2cc3ccccc3cc2C(=O)NC2(C(=O)O)CCCCCC2)c(C)c1 Homo sapiens CHEMBL1034792 assay format
CHEMBL457860 OBDepict Cl N H N H O F F HO F F IC50 = 36.0 nM 412.77 O=C(Nc1c(F)cc2c(c1F)CCC(F)(F)C2O)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL990750 assay format
CHEMBL233657 OBDepict HO N HO O N H O N H S Cl Cl IC50 = 38.0 nM 468.36 O=C(NC1Cc2ccccc2N(CC(CO)CO)C1=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL114950 OBDepict CH 3 N CH 3 O OH O O O HO H 3 C CH 3 Cl IC50 = 39.0 nM 407.85 CCN1C(C)=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C1C(=O)O Homo sapiens CHEMBL712595 assay format
CHEMBL475765 OBDepict CH 3 HN H O HO O N H N H O CH 3 CH 3 H 3 C IC50 = 39.0 nM 447.54 CCC[C@H](NC(=O)c1cc2ccccc2cc1NC(=O)Nc1c(C)cc(C)cc1C)C(=O)O Homo sapiens CHEMBL1034807 assay format
CHEMBL132430 OBDepict I N N H O O O HO O HO IC50 = 39.0 nM 504.24 O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc(I)ccn1 Homo sapiens CHEMBL680561 assay format
CHEMBL394527 OBDepict HO OH H N O H N H O N H S Cl IC50 = 40.0 nM 419.89 O=C(N[C@@H]1Cc2ccccc2N(C[C@@H](O)CO)C1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL889956 single protein format
CHEMBL1082392 OBDepict HO O S H H HN O N H S Cl Cl IC50 = 40.0 nM 455.39 O=C(O)CSC[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL1084228 OBDepict Cl S N H NH O H H O OH IC50 = 40.0 nM 374.85 O=C(O)C[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL218287 OBDepict O HN HN O N H S Cl IC50 = 41.0 nM 345.81 O=C(NC1Cc2ccccc2NC1=O)c1cc2cc(Cl)sc2[nH]1 Homo sapiens CHEMBL909563 assay format
CHEMBL1085086 OBDepict HO O S O O H H N H O N H S Cl Cl IC50 = 42.0 nM 515.44 O=C(O)CCCS(=O)(=O)C[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sc(Cl)c(Cl)c2[nH]1 Homo sapiens CHEMBL1120661 assay format
CHEMBL180652 OBDepict OH N O N H O N H Cl IC50 = 42.0 nM 377.87 O=C(NCC(=O)N(CCCO)C1CCCC1)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL826961 single protein format
CHEMBL114271 OBDepict H 3 C O CH 3 O CH 3 N O OH Cl F F F O OH IC50 = 43.0 nM 461.82 CC1=C(C(=O)OC(C)C)C(c2ccccc2Cl)C(C(=O)O)=C(C(=O)O)N1CC(F)(F)F Homo sapiens CHEMBL712595 assay format
CHEMBL234952 OBDepict OH HO H N O N H O N H Cl IC50 = 44.0 nM 413.86 O=C(NC1Cc2ccccc2N(C[C@@H](O)CO)C1=O)c1cc2cc(Cl)ccc2[nH]1 Homo sapiens CHEMBL889956 single protein format