Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50135948'   

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))	BDBM50135948 (2-(4-Methoxy-phenyl)-5-methyl-2H-pyrazole-3-carbox...) Show SMILES COc1ccc(cc1)-n1nc(C)cc1C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C23H21N5O4S/c1-15-13-20(28(27-15)17-8-10-18(32-2)11-9-17)23(29)26-22-12-7-16(14-25-22)19-5-3-4-6-21(19)33(24,30)31/h3-14H,1-2H3,(H2,24,30,31)(H,25,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Tested in vitro for inhibition of human Coagulation factor X				J Med Chem 46: 5298-315 (2003) Article DOI: 10.1021/jm030212h BindingDB Entry DOI: 10.7270/Q2ZW1MP2
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