Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM98169'   

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))	BDBM98169 (US8487111, 10) Show SMILES Cc1cc(ccc1-n1cccc(CCCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O5S/c1-15-12-17(6-7-19(15)27-10-2-4-16(23(27)31)5-3-11-29)28-14-18(33-24(28)32)13-26-22(30)20-8-9-21(25)34-20/h2,4,6-10,12,18,29H,3,5,11,13-14H2,1H3,(H,26,30)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	74	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Intellectual Property GmbH US Patent					Assay Description Thrombin inhibitory activity.				US Patent US8487111 (2013) BindingDB Entry DOI: 10.7270/Q29K48V9
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