Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Xanthine dehydrogenase/oxidase' and Ligand = 'BDBM50234447'   

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))	BDBM50234447 (CHEMBL4095793) Show SMILES CCCCCCn1cc(COc2ccc(F)cc2C=O)nn1 Show InChI InChI=1S/C16H20FN3O2/c1-2-3-4-5-8-20-10-15(18-19-20)12-22-16-7-6-14(17)9-13(16)11-21/h6-7,9-11H,2-5,8,12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Medical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid levels using xanthine as substrate after 120 mins by spectrophotometry				Bioorg Med Chem Lett 27: 729-732 (2017) Article DOI: 10.1016/j.bmcl.2017.01.049 BindingDB Entry DOI: 10.7270/Q2GX4DS2
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