Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50172833'   

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
Prothrombin (Homo sapiens (Human))	BDBM50172833 (CHEMBL198071 | [2-(3-Chloro-benzyl)-6-methyl-oxazo...) Show SMILES Cc1cc2oc(Cc3cccc(Cl)c3)nc2c(NCCC2CCCCN2)n1 Show InChI InChI=1S/C21H25ClN4O/c1-14-11-18-20(21(25-14)24-10-8-17-7-2-3-9-23-17)26-19(27-18)13-15-5-4-6-16(22)12-15/h4-6,11-12,17,23H,2-3,7-10,13H2,1H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory constant against thrombin				Bioorg Med Chem Lett 15: 4411-6 (2005) Article DOI: 10.1016/j.bmcl.2005.07.022 BindingDB Entry DOI: 10.7270/Q22Z153P
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