Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor VII/Tissue factor' and Ligand = 'BDBM50440830'   

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 VII/Tissue factor (Homo sapiens (Human))	BDBM50440830 (CHEMBL2431592) Show SMILES CCOc1cc(ccc1OC(C)C)C(Nc1ccc2nc(N)[nH]c2c1)C(=O)NS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C26H29N5O5S/c1-4-35-23-14-17(10-13-22(23)36-16(2)3)24(25(32)31-37(33,34)19-8-6-5-7-9-19)28-18-11-12-20-21(15-18)30-26(27)29-20/h5-16,24,28H,4H2,1-3H3,(H,31,32)(H3,27,29,30)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb R&D Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble tissue factor-factor 7a using H-D-Ile-Pro-Arg-pNA as substrate				Bioorg Med Chem Lett 23: 5244-8 (2013) Article DOI: 10.1016/j.bmcl.2013.06.027 BindingDB Entry DOI: 10.7270/Q2S46TDQ
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