Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Xanthine dehydrogenase/oxidase' and Ligand = 'BDBM121546'   

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
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM121546 (US8729273, 16) Show SMILES OC(=O)c1cn(nc1C(F)(F)F)-c1ccc2n(CC3CC3)cc(C#N)c2c1 Show InChI InChI=1S/C18H13F3N4O2/c19-18(20,21)16-14(17(26)27)9-25(23-16)12-3-4-15-13(5-12)11(6-22)8-24(15)7-10-1-2-10/h3-5,8-10H,1-2,7H2,(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
LG Life Sciences Ltd. US Patent					Assay Description Xanthine oxidase originated from bovine milk was incubated for 3 min with test compounds, and the initial velocity of uric acid formation was determi...				US Patent US8729273 (2014) BindingDB Entry DOI: 10.7270/Q2D79937
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