HOME LIGAND hPROTEOME OTHERS DOCUMENT

P42356 | PI4KA_HUMAN | Phosphatidylinositol 4-kinase alpha (PI4KA)

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
CHEMBL4855542 OBDepict NH 2 N S N O NH IC50 = -16100.0 nM 372.45 Nc1ncc(-c2cccc3ncsc23)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804463 cell-based format
CHEMBL4860979 OBDepict F S N O O CH 3 N H 2 N O N H IC50 = -13200.0 nM 466.54 CN(C1CC1)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc4c(c3)CCNC4=O)c2)c(F)c1 Homo sapiens CHEMBL4804463 cell-based format
CHEMBL4859660 OBDepict NH 2 N F + N O NH O _ O IC50 = -5500.0 nM 378.36 Nc1ncc(-c2cccc([N+](=O)[O-])c2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804463 cell-based format
CHEMBL4868141 OBDepict H 2 N N O O HN NH S O O IC50 = -2900.0 nM 532.67 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2OC2CCCCC2)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804463 cell-based format
CHEMBL4855730 OBDepict F NH S N O O H 2 N O HN IC50 = 100.0 nM 452.51 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804463 cell-based format
CHEMBL4161766 OBDepict CH 3 H 3 C H 2 N H N H O N S CH 3 N N H Cl S O O CH 3 IC50 = 130.6 nM 494.04 Cc1ccccc1S(=O)(=O)Nc1cc(-c2sc(NC(=O)[C@@H](N)C(C)C)nc2C)cnc1Cl Homo sapiens CHEMBL4156830 single protein format
CHEMBL4164334 OBDepict CH 3 H 3 C H 2 N H N H O N S CH 3 N N H Cl S O O CH 3 IC50 = 163.7 nM 494.04 Cc1ccc(S(=O)(=O)Nc2cc(-c3sc(NC(=O)[C@@H](N)C(C)C)nc3C)cnc2Cl)cc1 Homo sapiens CHEMBL4156830 single protein format
CHEMBL3901551 OBDepict O N H N H N S O O N CH 3 CH 3 CH 3 N Cl IC50 = 450.0 nM 486.0 CC(C)(C)OC(=O)CCNC(=O)Nc1nc2c(s1)-c1nc(-c3ccccc3Cl)ncc1CC2 Homo sapiens CHEMBL3864064 cell-based format
CHEMBL3947384 OBDepict H 3 C O S N H O O H 2 N N CH 3 N N Cl N H N H 3 C IC50 = 553.0 nM 584.15 CCc1cc(CNc2cc(Cl)nn3c(-c4ccc(OC)c(S(=O)(=O)NC5CCC(N)CC5)c4)c(C)nc23)ccn1 Homo sapiens CHEMBL3864068 single protein format
CHEMBL4174988 OBDepict CH 3 H 3 C H 2 N H N H O N S CH 3 N N H Cl S O O CH 3 IC50 = 574.1 nM 494.04 Cc1cccc(S(=O)(=O)Nc2cc(-c3sc(NC(=O)[C@@H](N)C(C)C)nc3C)cnc2Cl)c1 Homo sapiens CHEMBL4156830 single protein format
CHEMBL3986552 OBDepict H 3 C O S N H O O H 2 N N H 3 C N N Cl N H N H O CH 3 IC50 = 660.0 nM 550.09 COc1ccc(-c2c(C)nc3c(NCCNC(C)=O)cc(Cl)nn23)cc1S(=O)(=O)NC1CCC(N)CC1 Homo sapiens CHEMBL3864068 single protein format