HOME LIGAND hPROTEOME OTHERS DOCUMENT

A5PKW4 | PSD1_HUMAN | PH and SEC7 domain-containing protein 1 (PSD)

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
CHEMBL4574541 OBDepict Cl Cl N N N H F F F O N IC50 = 250.0 nM 501.3 O=c1cc(-c2cccc(-c3cccnc3)c2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4560033 OBDepict F O F N H O N N F F F Cl Cl IC50 = 330.0 nM 552.29 O=c1cc(-c2cccc(Oc3cc(F)cc(F)c3)c2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4525424 OBDepict Cl N N N H F F F O N H O IC50 = 500.0 nM 508.89 O=C(Nc1ccc(-c2cc(=O)n3nc(C(F)(F)F)c(-c4ccc(Cl)cc4)c3[nH]2)cc1)c1ccccc1 Homo sapiens CHEMBL4476963 assay format
CHEMBL4574204 OBDepict Cl Cl N N N H F F F O O IC50 = 520.0 nM 516.31 O=c1cc(-c2cccc(Oc3ccccc3)c2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4540870 OBDepict CH 3 O HO + N HN N H O _ O O S CH 3 CH 3 CH 3 IC50 = 560.0 nM 445.54 CCC(C)(C)C1CCc2c(sc3c2C(=O)NC(c2cc(OC)c(O)c([N+](=O)[O-])c2)N3)C1 Homo sapiens CHEMBL4476963 assay format
CHEMBL4585299 OBDepict _ O + N O N H O N N Cl Cl IC50 = 580.0 nM 477.31 O=c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(-c3ccccc3)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4534219 OBDepict Cl Cl N N N H F F F O O IC50 = 660.0 nM 516.31 O=c1cc(-c2ccc(Oc3ccccc3)cc2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4555543 OBDepict _ O + N O N H O N N F F F Cl Cl IC50 = 660.0 nM 469.21 O=c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4540598 OBDepict _ O + N O N H O N N F F F Cl F F F IC50 = 670.0 nM 502.76 O=c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]c2c(-c3ccc(Cl)c(C(F)(F)F)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4559227 OBDepict Cl Cl N N N H F F F O IC50 = 840.0 nM 438.24 O=c1cc(Cc2ccccc2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4531207 OBDepict Cl N N N H F F F O Cl + N O _ O IC50 = 880.0 nM 469.21 O=c1c(Cl)c(-c2ccc([N+](=O)[O-])cc2)[nH]c2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4546661 OBDepict Cl N N N H O + N O _ O IC50 = 960.0 nM 442.86 O=c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]c2c(-c3ccc(Cl)cc3)c(-c3ccccc3)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4591591 OBDepict Cl N N N H F F F O N CH 3 IC50 = 960.0 nM 480.88 Cc1ccc(-c2cccc(-c3cc(=O)n4nc(C(F)(F)F)c(-c5ccc(Cl)cc5)c4[nH]3)c2)cn1 Homo sapiens CHEMBL4476963 assay format
CHEMBL4574371 OBDepict Cl N N N H F F F O Cl IC50 = 980.0 nM 424.21 O=c1c(Cl)c(-c2ccccc2)[nH]c2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn12 Homo sapiens CHEMBL4476963 assay format
CHEMBL4535892 OBDepict Cl Cl N N N H O O IC50 = 1000.0 nM 488.37 O=c1cc(-c2cccc(Oc3ccccc3)c2)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C3CC3)nn12 Homo sapiens CHEMBL4476963 assay format