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Q16880 | CGT_HUMAN | 2-hydroxyacylsphingosine 1-beta-galactosyltransferase (UGT8)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4785914 OBDepict H 3 C N H O S N N F F F O NH O H 3 C H O F F F IC50 = 0.2 nM 528.48 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)N[C@@H](C)COC(F)(F)F)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4796521 OBDepict H 3 C N H O S N N F F F O NH O O F F F IC50 = 0.4 nM 514.45 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)NCCOC(F)(F)F)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4750073 OBDepict CH 3 N H O S N N F F F O N H O H 3 C H IC50 = 0.9 nM 470.52 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)N[C@@H](C)C4CC4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4787939 OBDepict CH 3 HN CH 3 H O O N N S F F F NH O H 3 C IC50 = 0.9 nM 458.51 CC[C@H](C)NC(=O)OC1CCN(c2cc(C(F)(F)F)c3scc(C(=O)NC)c3n2)CC1 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4776963 OBDepict CH 3 N H O S N N F F F O N H O IC50 = 1.0 nM 456.49 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)NCC4CC4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4750432 OBDepict CH 3 HN O S N N F F F O N O O F F F IC50 = 1.7 nM 526.46 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)N4CC(OC(F)(F)F)C4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4765010 OBDepict H 3 C N H O S N N F F F O NH O CH 3 H 3 C IC50 = 2.0 nM 444.48 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)NC(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4755797 OBDepict CH 3 N H O S N N F F F N H O O IC50 = 18.0 nM 456.49 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(NC(=O)OCC4CC4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4757982 OBDepict H 3 C NH O S N N F F F N H O O IC50 = 48.0 nM 428.44 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CC(NC(=O)OCC4CC4)C3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4760937 OBDepict H 3 C N H O S N N F F F N NH O CH 3 H 3 C IC50 = 67.0 nM 443.5 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(CC(=O)NC(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4795937 OBDepict H 3 C O S N N F F F N NH O CH 3 H 3 C IC50 = 97.0 nM 442.51 CCC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(CC(=O)NC(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4799472 OBDepict CH 3 N H O S N N F F F N CH 3 HN O IC50 = 170.0 nM 455.51 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(C(C)C(=O)NC4CC4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4797076 OBDepict CH 3 N H O S N N F F F N OH O CH 3 CH 3 CH 3 IC50 = 190.0 nM 474.55 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(CC(O)COC(C)(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4764180 OBDepict H 3 C NH O S N N F F F O N H O IC50 = 200.0 nM 428.44 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CC(OC(=O)NCC4CC4)C3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4751927 OBDepict H 3 C N H O S N N F F F N O CH 3 H 3 C IC50 = 330.0 nM 430.5 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(CCOC(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4799203 OBDepict H 3 C N H O S N N F F F O NH O N IC50 = 510.0 nM 499.56 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)NCCN4CCCC4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4762406 OBDepict CH 3 N H O S N N F F F O N H O IC50 = 610.0 nM 442.46 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)NCC4CC4)C3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4791074 OBDepict H 3 C N H O S N N F F F N O CH 3 H 3 C CH 3 IC50 = 610.0 nM 442.51 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(CC(=O)C(C)(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4747085 OBDepict H 3 C HN CH 3 O N N N S F F F N O IC50 = 640.0 nM 469.53 CC(C)NC(=O)CN1CCN(c2cc(C(F)(F)F)c3scc(C(=O)N4CCC4)c3n2)CC1 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4745037 OBDepict H 3 C N H O S N N F F F N O O CH 3 H 3 C IC50 = 660.0 nM 444.48 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCN(C(=O)COC(C)C)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format
CHEMBL4752928 OBDepict CH 3 HN O S N N F F F O N O N CH 3 CH 3 IC50 = 980.0 nM 499.56 CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(OC(=O)N4CC(CN(C)C)C4)CC3)nc12 Homo sapiens CHEMBL4731219 cell-based format