Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Xanthine dehydrogenase/oxidase' and Ligand = 'BDBM50333137'   

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 (Rattus norvegicus)	BDBM50333137 (7-methyl-2-(phenoxymethyl)-5H-[1,3,4]thiadiazolo[3...) Show SMILES Cc1cc(=O)n2nc(COc3ccccc3)sc2n1 Show InChI InChI=1S/C13H11N3O2S/c1-9-7-12(17)16-13(14-9)19-11(15-16)8-18-10-5-3-2-4-6-10/h2-7H,8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	555	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of rat liver xanthine oxidase by spectrophotometry				Bioorg Med Chem 19: 211-20 (2011) Article DOI: 10.1016/j.bmc.2010.11.034 BindingDB Entry DOI: 10.7270/Q26H4HPB
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