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Q96T53 | MBOA4_HUMAN | Ghrelin O-acyltransferase (MBOAT4)

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
CHEMBL4793203 OBDepict N NH N CH 3 N H 2 N N N O IC50 = 0.02 nM 321.34 Cc1nc2nonc2c(N)c1Cc1ccc(C#N)c(NC2CC2)n1 Homo sapiens CHEMBL4673674 cell-based format
CHEMBL4746798 OBDepict CH 3 N N N H 2 N O N N N F F F IC50 = 0.028 nM 375.31 Cc1nc2nonc2c(N)c1Cn1ccc(-c2cccc(C(F)(F)F)n2)n1 Homo sapiens CHEMBL4673674 cell-based format
CHEMBL4754865 OBDepict CH 3 O F F F CH 3 N NH 2 N N O IC50 = 0.066 nM 338.29 COc1cc(C(F)(F)F)ccc1Cc1c(C)nc2nonc2c1N Homo sapiens CHEMBL4673674 cell-based format
CHEMBL4781133 OBDepict F O F N Br CH 3 N NH 2 N N N IC50 = 0.13 nM 385.17 Cc1nc2ncnn2c(N)c1Cc1ccc(Br)c(OC(F)F)n1 Homo sapiens CHEMBL4673674 cell-based format
CHEMBL4789143 OBDepict CH 3 N N N NH 2 O N O F F F IC50 = 0.56 nM 331.3 Cc1nc2nonc2c(N)c1CN1CCC(OC(F)(F)F)CC1 Homo sapiens CHEMBL4673674 cell-based format
CHEMBL4785875 OBDepict HO O S Cl Cl O CH 3 N F F F IC50 = 1.7 nM 450.26 Cc1nc(C(F)(F)F)ccc1COc1cc(Cl)c2cc(CC(=O)O)sc2c1Cl Homo sapiens CHEMBL4673668 microsome format
CHEMBL4791105 OBDepict Cl Cl S N O O OH IC50 = 8.6 nM 354.21 O=C(O)c1ccc2oc(SCc3ccc(Cl)cc3Cl)nc2c1 Homo sapiens CHEMBL4673668 microsome format
CHEMBL4764363 OBDepict OH O S Cl O H N IC50 < 50.0 nM 359.83 O=C(O)Cc1csc2cc(O[C@H]3CCc4ncccc43)cc(Cl)c12 Homo sapiens CHEMBL4673673 cell membrane format
CHEMBL4741187 OBDepict Cl N N CH 3 NH 2 N O HN CH 3 H O N CH 3 N H IC50 = 54.4 nM 433.94 Cc1nc(Cl)nc(N)c1CCC1CCN(C(=O)[C@H](C)NC(=O)c2cn[nH]c2C)CC1 Homo sapiens CHEMBL4673662 cell membrane format
CHEMBL4741216 OBDepict H 2 N N N NH 2 Cl N O HN CH 3 H O N N H 3 C IC50 = 68.9 nM 434.93 C[C@H](NC(=O)c1ccn(C)n1)C(=O)N1CCC(CCc2c(N)nc(N)nc2Cl)CC1 Homo sapiens CHEMBL4673662 cell membrane format
CHEMBL4756266 OBDepict CH 3 N N H 2 N F F F N O NH H 3 C H O N H 3 C N IC50 = 69.5 nM 467.5 Cc1nc(C(F)(F)F)nc(N)c1CCC1CCN(C(=O)[C@H](C)NC(=O)c2ccnn2C)CC1 Homo sapiens CHEMBL4673662 cell membrane format
CHEMBL4760639 OBDepict H 3 C N N NH 2 Cl N O HN CH 3 H O S N CH 3 IC50 = 96.4 nM 451.0 Cc1nc(N)c(CCC2CCN(C(=O)[C@H](C)NC(=O)c3cnc(C)s3)CC2)c(Cl)n1 Homo sapiens CHEMBL4673662 cell membrane format
CHEMBL4753838 OBDepict CH 3 O HN O CH 3 H N O NH 2 N Cl N H 3 C IC50 = 149.0 nM 383.88 COC(=O)N[C@@H](C)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1 Homo sapiens CHEMBL4673662 cell membrane format
CHEMBL4742847 OBDepict NH 2 N N NH 2 Cl N O NH H 3 C H O IC50 = 192.0 nM 394.91 C[C@H](NC(=O)C1CC1)C(=O)N1CCC(CCc2c(N)nc(N)nc2Cl)CC1 Homo sapiens CHEMBL4673662 cell membrane format