Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50125038'   

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))	BDBM50125038 (2-[(S)-3-(3-Guanidino-propyl)-2-oxo-piperazin-1-yl...) Show SMILES NC(=N)NCCC[C@H](NC(=O)CN1CCN[C@@H](CCCNC(N)=N)C1=O)C(=O)c1nccs1 Show InChI InChI=1S/C19H32N10O3S/c20-18(21)26-5-1-3-12(15(31)16-25-8-10-33-16)28-14(30)11-29-9-7-24-13(17(29)32)4-2-6-27-19(22)23/h8,10,12-13,24H,1-7,9,11H2,(H,28,30)(H4,20,21,26)(H4,22,23,27)/t12-,13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against serine protease thrombin				Bioorg Med Chem Lett 13: 729-32 (2003) BindingDB Entry DOI: 10.7270/Q2T72GTS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50125038 (2-[(S)-3-(3-Guanidino-propyl)-2-oxo-piperazin-1-yl...) Show SMILES NC(=N)NCCC[C@H](NC(=O)CN1CCN[C@@H](CCCNC(N)=N)C1=O)C(=O)c1nccs1 Show InChI InChI=1S/C19H32N10O3S/c20-18(21)26-5-1-3-12(15(31)16-25-8-10-33-16)28-14(30)11-29-9-7-24-13(17(29)32)4-2-6-27-19(22)23/h8,10,12-13,24H,1-7,9,11H2,(H,28,30)(H4,20,21,26)(H4,22,23,27)/t12-,13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development Curated by ChEMBL					Assay Description Inhibition of human alpha-thrombin				Bioorg Med Chem 16: 1562-95 (2008) Article DOI: 10.1016/j.bmc.2007.11.015 BindingDB Entry DOI: 10.7270/Q21J9BNH
					More data for this Ligand-Target Pair