Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50127887'   

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))	BDBM50127887 (3-(4-Iodo-phenyl)-4,5-dihydro-isoxazole-5-carboxyl...) Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(=NO2)c2ccc(I)cc2)cc1 |c:20| Show InChI InChI=1S/C22H18IN3O4S/c23-16-9-5-15(6-10-16)19-13-20(30-26-19)22(27)25-17-11-7-14(8-12-17)18-3-1-2-4-21(18)31(24,28)29/h1-12,20H,13H2,(H,25,27)(H2,24,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Binding affinity of the compound against the coagulation factor X				Bioorg Med Chem Lett 13: 1795-9 (2003) BindingDB Entry DOI: 10.7270/Q2N29WBV
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