Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50177429'   

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))	BDBM50177429 (CHEMBL536053 | N-(3-(2-(4-carbamimidoylbenzylamino...) Show SMILES Cc1ccc(NC(=O)c2ccccc2)c(O)c1CC(=O)NCc1ccc(cc1)C(N)=N Show InChI InChI=1S/C24H24N4O3/c1-15-7-12-20(28-24(31)18-5-3-2-4-6-18)22(30)19(15)13-21(29)27-14-16-8-10-17(11-9-16)23(25)26/h2-12,30H,13-14H2,1H3,(H3,25,26)(H,27,29)(H,28,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montr£al Curated by ChEMBL					Assay Description Inhibitory activity against thrombin				Bioorg Med Chem Lett 16: 1032-6 (2006) Article DOI: 10.1016/j.bmcl.2005.10.082 BindingDB Entry DOI: 10.7270/Q2V125K5
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