Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50157327'   

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))	BDBM50157327 (7-[1-(1-Imino-ethyl)-piperidin-4-ylmethoxy]-3,4-di...) Show SMILES CC(=N)N1CCC(COc2ccc3CCN(Cc3c2)C(N)=N)CC1 Show InChI InChI=1S/C18H27N5O/c1-13(19)22-7-4-14(5-8-22)12-24-17-3-2-15-6-9-23(18(20)21)11-16(15)10-17/h2-3,10,14,19H,4-9,11-12H2,1H3,(H3,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory concentration against human Coagulation factor II (thrombin)				J Med Chem 48: 3586-604 (2005) Article DOI: 10.1021/jm058160e BindingDB Entry DOI: 10.7270/Q2CR5V36
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