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P13866 | SC5A1_HUMAN | Sodium/glucose cotransporter 1 (SLC5A1)

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
CHEMBL485830 OBDepict OH HN H N O O H NH 2 H O HO O NH 2 IC50 = 0.16 nM 330.34 NC(=O)CC[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O Homo sapiens CHEMBL974294 assay format
CHEMBL521026 OBDepict OH N H H N H O O H H N O HO O CH 3 O NH 2 IC50 = 0.17 nM 372.38 CC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O Homo sapiens CHEMBL974294 assay format
CHEMBL4297625 OBDepict CH 3 H O H HO O H H HO O OH H OH IC50 = 0.5 nM 416.47 CCc1ccc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc2c(c1)OCCO2 Homo sapiens CHEMBL4727638 single protein format
CHEMBL3690855 OBDepict Cl N N N H O H CH 3 H 3 C CH 3 NH H H 3 C O IC50 = 0.7 nM 450.97 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(C(C)(C)C)c2)n(-c2ccccc2Cl)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686477 OBDepict O N H H N H O N N Cl H 3 C H 3 C CH 3 IC50 = 0.9 nM 436.94 CC(C)(C)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690821 OBDepict CH 3 F F N N N H O H HN H CH 3 O IC50 = 1.1 nM 438.48 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)[C@@H]3C)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686485 OBDepict CH 3 F F N N N H Cl O H N H O IC50 = 1.1 nM 458.9 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695107 OBDepict CH 3 O N F N N H O H O N H O H 3 C H F F F IC50 = 1.1 nM 534.51 CCOc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686471 OBDepict Cl N N N H O H H 3 C H 3 C CH 3 N H O IC50 = 1.2 nM 436.94 CC(C)(C)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2cccc(Cl)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690854 OBDepict Cl N N N H O O H HN H CH 3 F F F O IC50 = 1.3 nM 478.86 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(OC(F)(F)F)c2)n(-c2ccccc2Cl)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686489 OBDepict CH 3 F F N N N H H 3 C O H N H O IC50 = 1.3 nM 438.48 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2C)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690868 OBDepict CH 3 F F N N N H Cl O H HN H CH 3 O IC50 = 1.3 nM 472.92 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)[C@@H]3C)nn2-c2ccccc2Cl)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686475 OBDepict O NH H N H O N N Cl O F F F IC50 = 1.3 nM 464.83 O=C1C[C@@H](C(=O)Nc2cc(-c3cccc(OC(F)(F)F)c3)n(-c3ccccc3Cl)n2)CN1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695108 OBDepict O N H H N H O N N F O O CH 3 CH 3 H 3 C H F F F IC50 = 1.4 nM 548.54 CC(C)Oc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686472 OBDepict H 3 C N N N H O H H 3 C CH 3 H 3 C N H O IC50 = 1.4 nM 416.53 Cc1cccc(-n2nc(NC(=O)[C@H]3CNC(=O)C3)cc2-c2cccc(C(C)(C)C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686463 OBDepict CH 3 N N N H F O H N H O IC50 = 1.4 nM 406.46 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690875 OBDepict Cl N N N H O O H HN H CH 3 O F F F IC50 = 1.4 nM 492.89 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(OCC(F)(F)F)c2)n(-c2ccccc2Cl)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690863 OBDepict Cl N N N H O H F F F NH H H 3 C O IC50 = 1.4 nM 462.86 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(C(F)(F)F)c2)n(-c2ccccc2Cl)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695105 OBDepict O N H H N H O N N F O O CH 3 CH 3 F F F IC50 = 1.4 nM 534.51 CC(C)Oc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686483 OBDepict O N H H N H O N N F F H 3 C CH 3 IC50 = 1.5 nM 438.48 CC(C)C(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690989 OBDepict CH 3 N N N H O N H O IC50 = 1.5 nM 414.51 CCCc1cccc(-c2cc(NC(=O)C3CNC(=O)C34CC4)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690942 OBDepict CH 3 N N N H O S O O IC50 = 1.5 nM 437.57 CCCc1cccc(-c2cc(NC(=O)C3CCS(=O)(=O)CC3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686422 OBDepict O N H H N H O N N H 3 C CH 3 IC50 = 1.6 nM 402.5 CC(C)Cc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686428 OBDepict CH 3 N N N H O CH 3 H N H O IC50 = 1.7 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2cccc(C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686484 OBDepict CH 3 F F N N N H O Cl H N H O IC50 = 1.7 nM 458.9 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2cccc(Cl)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695097 OBDepict CH 3 O N N N H O H O N H O H 3 C H F F F IC50 = 1.7 nM 530.55 CCCOc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695096 OBDepict CH 3 O N N N H O H O N H O H 3 C H F F F IC50 = 1.7 nM 516.52 CCOc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695109 OBDepict CH 3 O O N F N N H O H O N H O H 3 C H F F F IC50 = 1.7 nM 564.54 COCCOc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686440 OBDepict CH 3 N N N H O H HN H CH 3 O IC50 = 1.8 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)[C@@H]3C)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL1807551 OBDepict HO H O H OH H H HO H HO Cl IC50 = 1.8 nM 404.89 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(C4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1811698 cell-based format
CHEMBL3686379 OBDepict O N H H N H O N N CH 3 CH 3 H 3 C IC50 = 1.8 nM 402.5 CC(C)(C)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695170 OBDepict CH 3 O F N N N H O H O N H O H 3 C H F F F IC50 = 1.8 nM 534.51 CCOc1cc(F)cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686447 OBDepict CH 3 N N N H Cl O H N H O IC50 = 1.9 nM 422.92 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL4093607 OBDepict CH 3 S H O H OH H H OH H HO H 3 C O N H H 3 C CH 3 N H 3 C CH 3 IC50 = 2.0 nM 546.77 CS[C@H]1O[C@@H](c2ccc(C)c(Cc3ccc(OCCCNCC(C)(C)CN(C)C)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4003745 cell-based format
CHEMBL3695098 OBDepict O N H H N H O N N O O CH 3 CH 3 H 3 C H F F F IC50 = 2.0 nM 530.55 CC(C)Oc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL486028 OBDepict SH HN H O HO O N H H 3 C H O H N O H 3 C IC50 = 2.0 nM 331.39 CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O Homo sapiens CHEMBL974294 assay format
CHEMBL3686429 OBDepict CH 3 N N N H O CH 3 H N H O IC50 = 2.0 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695079 OBDepict O N H H N H O N N O O F H 3 C CH 3 CH 3 H F F F IC50 = 2.05 nM 548.54 CC(C)Oc1cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)ccc1F Homo sapiens CHEMBL3705647 assay format
CHEMBL3695104 OBDepict H 3 C O N F N N H O H O N H O F F F IC50 = 2.1 nM 520.48 CCOc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL485831 OBDepict SH HN H N O O H NH 2 H O HO O NH 2 IC50 = 2.1 nM 346.41 NC(=O)CC[C@H](N)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)O Homo sapiens CHEMBL974294 assay format
CHEMBL3690883 OBDepict H 3 C N N N H O O H HN H CH 3 O F F F IC50 = 2.1 nM 472.47 Cc1ccccc1-n1nc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)cc1-c1cccc(OCC(F)(F)F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695169 OBDepict CH 3 O F N N N H O H O N H O H 3 C H F F F IC50 = 2.1 nM 520.48 COc1cc(F)cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695161 OBDepict CH 3 O N F N N H O H O N H O H 3 C H F F F IC50 = 2.15 nM 520.48 COc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690960 OBDepict CH 3 N N N H H 3 C O CH 3 H N H O IC50 = 2.2 nM 416.53 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cc(C)ccc2C)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686449 OBDepict CH 3 N N N H H 3 C O H N H O IC50 = 2.2 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2C)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL4060670 OBDepict CH 3 S H O H OH H H OH H HO H 3 C N H H 3 C CH 3 O H 2 N IC50 = 2.3 nM 530.73 CS[C@H]1O[C@@H](c2ccc(C)c(Cc3ccc(CCCCNCC(C)(C)C(N)=O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4003745 cell-based format
CHEMBL3690874 OBDepict O NH H N H O N N Cl O F F F IC50 = 2.3 nM 478.86 O=C1C[C@@H](C(=O)Nc2cc(-c3cccc(OCC(F)(F)F)c3)n(-c3ccccc3Cl)n2)CN1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690879 OBDepict CH 3 N N N H O O H NH H H 3 C F F F O IC50 = 2.3 nM 458.44 Cc1ccccc1-n1nc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)cc1-c1cccc(OC(F)(F)F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695167 OBDepict O N H H N H O N N F O O CH 3 CH 3 F F F IC50 = 2.3 nM 534.51 CC(C)Oc1cc(F)cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695093 OBDepict O N H H N H O N N O O CH 3 CH 3 F F F IC50 = 2.3 nM 516.52 CC(C)Oc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL1808388 OBDepict HO H O H HO H H OH H OH Cl O O IC50 = 2.3 nM 464.94 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1811698 cell-based format
CHEMBL3695072 OBDepict O N H H N H O N N O F O H 3 C CH 3 F F F IC50 = 2.35 nM 534.51 CC(C)Oc1cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)ccc1F Homo sapiens CHEMBL3705647 assay format
CHEMBL3686443 OBDepict CH 3 N N N H O Cl H N H O IC50 = 2.4 nM 422.92 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2cccc(Cl)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL4072070 OBDepict OH HN CH 3 CH 3 O O Cl H O H HO H S H OH CH 3 H OH IC50 = 2.4 nM 554.11 CS[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCCC(=O)NC(C)(C)CO)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4003745 cell-based format
CHEMBL3686448 OBDepict CH 3 N N N H Cl O H N H O IC50 = 2.4 nM 422.92 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690831 OBDepict CH 3 O N N N H O H F F H 3 C N H O IC50 = 2.6 nM 454.48 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2cccc(OC)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690823 OBDepict O HN H N H O N N CH 3 O F F F IC50 = 2.7 nM 444.41 Cc1ccccc1-n1nc(NC(=O)[C@H]2CNC(=O)C2)cc1-c1cccc(OC(F)(F)F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690978 OBDepict H 3 C O N O NH H N H O N N H 3 C IC50 = 2.7 nM 447.54 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)N3CCOC)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695171 OBDepict O N H H N H O N N F O O H 3 C CH 3 CH 3 H F F F IC50 = 2.8 nM 548.54 CC(C)Oc1cc(F)cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690833 OBDepict F N N N H O O H HN H CH 3 F F F O IC50 = 2.9 nM 462.4 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(OC(F)(F)F)c2)n(-c2ccccc2F)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690956 OBDepict CH 3 N N N H O S O O IC50 = 3.0 nM 423.54 CCCc1cccc(-c2cc(NC(=O)C3CCS(=O)(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL4228878 OBDepict OH H O H OH H H OH H HO OH IC50 = 3.0 nM 412.48 OC[C@H]1O[C@@H](c2cc(Cc3ccc4c(c3)CC4)c(C3CC3)cc2O)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4221949 cell-based format
CHEMBL4225114 OBDepict H 3 C OH H O H HO H H OH HO H OH IC50 = 3.0 nM 400.47 CCc1cc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc2c(c1)CC2 Homo sapiens CHEMBL4221949 cell-based format
CHEMBL1807552 OBDepict HO H O H HO H H OH H OH Cl HO IC50 = 3.0 nM 420.89 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(C4(O)CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1811698 cell-based format
CHEMBL3690836 OBDepict CH 3 F F N N N H O F H HN H CH 3 O IC50 = 3.0 nM 456.47 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)[C@@H]3C)nn2-c2cccc(F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL1808389 OBDepict OH H O H OH H H HO H HO Cl O O IC50 = 3.0 nM 478.97 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(OCCOC4CCC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1811698 cell-based format
CHEMBL3695083 OBDepict O N H H N H O N N O O H 3 C H F F F IC50 = 3.1 nM 578.59 C[C@@H](OCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(OCc3ccccc3)c2)c1)C(F)(F)F Homo sapiens CHEMBL3705647 assay format
CHEMBL3695119 OBDepict O N H H N H O N N Cl O CH 3 H F F F IC50 = 3.1 nM 506.91 C[C@@H](OCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1)C(F)(F)F Homo sapiens CHEMBL3705647 assay format
CHEMBL3695099 OBDepict H 3 C O O N N N H O H O N H O CH 3 H F F F IC50 = 3.1 nM 546.55 COCCOc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690885 OBDepict F N N N H O H F F F NH H H 3 C O IC50 = 3.1 nM 446.4 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(C(F)(F)F)c2)n(-c2ccccc2F)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686426 OBDepict CH 3 F N N N H O H N H O IC50 = 3.1 nM 406.46 CCCc1cc(F)cc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695151 OBDepict O N H H N H O N N Cl F O CH 3 H F F F IC50 = 3.2 nM 524.9 C[C@@H](OCc1cc(F)cc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2Cl)c1)C(F)(F)F Homo sapiens CHEMBL3705647 assay format
CHEMBL3690954 OBDepict CH 3 N N N H O + S _ O IC50 = 3.2 nM 421.57 CCCc1cccc(-c2cc(NC(=O)C3CC[S+]([O-])CC3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695140 OBDepict CH 3 N N N H O H N H CH 3 O IC50 = 3.3 nM 430.55 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(CCC)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL4061935 OBDepict OH HN CH 3 CH 3 O H 3 C H O H HO H S H OH CH 3 H OH IC50 = 3.3 nM 505.68 CS[C@H]1O[C@@H](c2ccc(C)c(Cc3ccc(OCCCNC(C)(C)CO)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4003745 cell-based format
CHEMBL3690882 OBDepict O HN H N H O N N CH 3 O F F F IC50 = 3.3 nM 458.44 Cc1ccccc1-n1nc(NC(=O)[C@H]2CNC(=O)C2)cc1-c1cccc(OCC(F)(F)F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695095 OBDepict CH 3 O N N N H O H O N H O H 3 C H F F F IC50 = 3.3 nM 502.49 COc1cccc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690820 OBDepict O N H H N H O N N CH 3 CH 3 H 3 C Cl IC50 = 3.3 nM 436.94 CC(C)(C)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690976 OBDepict H 3 C N N N H O O H N H H 3 C CH 3 O IC50 = 3.35 nM 446.55 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(OC(C)C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695100 OBDepict H 3 C O O F N N N H O H O N H O H 3 C H F F F IC50 = 3.4 nM 564.54 COCCOc1cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)ccc1F Homo sapiens CHEMBL3705647 assay format
CHEMBL3690891 OBDepict O N H H N H O N N F O CH 3 H F F F IC50 = 3.4 nM 490.46 C[C@@H](OCc1cc(F)cc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1)C(F)(F)F Homo sapiens CHEMBL3705647 assay format
CHEMBL3695106 OBDepict CH 3 O O N F N N H O H O N H O F F F IC50 = 3.4 nM 550.51 COCCOc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690905 OBDepict O N H NH N O N O F F F IC50 = 3.4 nM 484.48 O=C(Nc1cc(-c2cccc(COCC(F)(F)F)c2)n(-c2ccccc2)n1)C1CNC(=O)C12CC2 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686357 OBDepict F N N N H O O H N H H CH 3 F F F O IC50 = 3.4 nM 462.4 C[C@H]1C(=O)NC[C@@H]1C(=O)Nc1cc(-c2cccc(OC(F)(F)F)c2)n(-c2ccc(F)cc2)n1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690825 OBDepict O N H H N H O N N F F H 3 C CH 3 Cl IC50 = 3.4 nM 472.92 CC(C)C(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695081 OBDepict CH 3 N N N H O O H N H H 3 C H 3 C CH 3 O IC50 = 3.45 nM 460.58 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(OC(C)(C)C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686380 OBDepict O N H H N H O N N CH 3 CH 3 H 3 C IC50 = 3.5 nM 402.5 CC(C)(C)c1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686423 OBDepict O N H H N H O N N H 3 C CH 3 IC50 = 3.5 nM 402.5 CC(C)Cc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686402 OBDepict CH 3 N N N H O H CH 3 N H O IC50 = 3.5 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccc(C)cc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695166 OBDepict CH 3 O F N N N H O H O N H O F F F IC50 = 3.6 nM 520.48 CCOc1cc(F)cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(COCC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690865 OBDepict O NH H N H O N N Cl F F F IC50 = 3.6 nM 448.83 O=C1C[C@@H](C(=O)Nc2cc(-c3cccc(C(F)(F)F)c3)n(-c3ccccc3Cl)n2)CN1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686406 OBDepict CH 3 H 3 C H 3 C N N N H O H N H O IC50 = 3.7 nM 416.53 CCC(C)(C)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695101 OBDepict H 3 C O F N N N H O H O N H O H 3 C H F F F IC50 = 3.7 nM 520.48 COc1cc(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(CO[C@H](C)C(F)(F)F)c2)ccc1F Homo sapiens CHEMBL3705647 assay format
CHEMBL3686400 OBDepict CH 3 N N N H O H N H O IC50 = 3.7 nM 402.5 CCCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3691018 OBDepict CH 3 N N N H O O H F N H CH 3 H 3 C O IC50 = 3.75 nM 464.54 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccc(F)c(OC(C)C)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690910 OBDepict CH 3 N N N H H 3 C O H N H O IC50 = 3.77 nM 402.5 CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2C)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3695155 OBDepict O N H H N H O N N F O O F F F CH 3 CH 3 IC50 = 3.8 nM 506.46 CC(C)Oc1ccc(F)c(-n2nc(NC(=O)[C@@H]3CNC(=O)C3)cc2-c2cccc(OC(F)(F)F)c2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3690845 OBDepict CH 3 F F N N N H F O H N H O IC50 = 3.8 nM 442.44 CCC(F)(F)c1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2F)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3686407 OBDepict CH 3 H 3 C H 3 C N N N H O H N H O IC50 = 3.8 nM 416.53 CCC(C)(C)c1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1 Homo sapiens CHEMBL3705647 assay format
CHEMBL3639897 OBDepict O N H H N H O N N F F O CH 3 H F F F IC50 = 3.85 nM 508.45 C[C@@H](OCc1cc(F)cc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2F)c1)C(F)(F)F Homo sapiens CHEMBL3705647 assay format