Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50114451'   

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))	BDBM50114451 (2-(3-Fluoro-naphthalen-2-yl)-5-trifluoromethyl-2H-...) Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2cc3ccccc3cc2F)C(F)(F)F)cc1 Show InChI InChI=1S/C27H18F4N4O3S/c28-21-13-17-5-1-2-6-18(17)14-22(21)35-23(15-25(34-35)27(29,30)31)26(36)33-19-11-9-16(10-12-19)20-7-3-4-8-24(20)39(32,37)38/h1-15H,(H,33,36)(H2,32,37,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against coagulation factor Xa				Bioorg Med Chem Lett 12: 1651-5 (2002) BindingDB Entry DOI: 10.7270/Q2VT1RFZ
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