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P56730 | NETR_HUMAN | Neurotrypsin (PRSS12)

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
CHEMBL4592545 OBDepict Cl HN O N H O HO O N N H Cl Cl IC50 = 400.0 nM 579.83 O=C(Nc1ccc(Cl)cc1)c1ccc(NC(=O)c2ccc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)cc2)c(C(=O)O)c1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4513696 OBDepict N HN O OH O N N H Cl Cl IC50 = 500.0 nM 527.37 N#Cc1ccc(-c2ccc(C(=O)O)c(NC(=O)c3ccc(-c4nc5cc(Cl)c(Cl)cc5[nH]4)cc3)c2)cc1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4518469 OBDepict Cl F N H O HN O HO O N N H Cl Cl IC50 = 500.0 nM 597.82 O=C(Nc1ccc(Cl)cc1F)c1ccc(NC(=O)c2ccc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)cc2)c(C(=O)O)c1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4539049 OBDepict H 3 C CH 3 N O CH 3 CH 3 N H O HO O N N H Cl Cl IC50 = 700.0 nM 581.5 CC(C)CN(CC(C)C)C(=O)c1ccc(NC(=O)c2ccc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)cc2)c(C(=O)O)c1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4514750 OBDepict Cl N H O HN O OH O N N H Cl Cl IC50 = 800.0 nM 579.83 O=C(Nc1ccc(Cl)cc1)c1ccc(C(=O)O)c(NC(=O)c2ccc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)cc2)c1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4577465 OBDepict Cl F HN O NH O OH O N H Cl IC50 = 900.0 nM 562.38 O=C(Nc1ccc(Cl)cc1F)c1ccc(NC(=O)c2[nH]c3ccc(Cl)cc3c2-c2ccccc2)c(C(=O)O)c1 Homo sapiens CHEMBL4476902 single protein format
CHEMBL4591214 OBDepict Cl N H O N H O HO O N N H 3 C Cl Cl IC50 = 900.0 nM 593.85 Cn1c(-c2ccc(C(=O)Nc3ccc(C(=O)Nc4ccc(Cl)cc4)cc3C(=O)O)cc2)nc2cc(Cl)c(Cl)cc21 Homo sapiens CHEMBL4476902 single protein format