Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50106068'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Coagulation factor X (Homo sapiens (Human))	BDBM50106068 ((S)-2-(1-Amino-isoquinoline-7-carbonyl)-1,2,3,4-te...) Show SMILES Nc1nccc2ccc(cc12)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc(cc1)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C32H27N5O4S/c33-30-27-17-23(10-9-21(27)15-16-35-30)32(39)37-19-24-6-2-1-5-22(24)18-28(37)31(38)36-25-13-11-20(12-14-25)26-7-3-4-8-29(26)42(34,40)41/h1-17,28H,18-19H2,(H2,33,35)(H,36,38)(H2,34,40,41)/t28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
COR Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Coagulation factor X was determined				Bioorg Med Chem Lett 11: 2947-50 (2001) BindingDB Entry DOI: 10.7270/Q27H1HW6
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