BDBM50333146 2-((2,4-dimethylphenoxy)methyl)-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one::CHEMBL1644712

SMILES: Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)c(C)c1

InChI Key: InChIKey=FDBXMPGHWHPJER-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50333146   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Xanthine dehydrogenase/oxidase (Rattus norvegicus)	BDBM50333146 (2-((2,4-dimethylphenoxy)methyl)-7-methyl-5H-[1,3,4...) Show SMILES Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)c(C)c1 Show InChI InChI=1S/C15H15N3O2S/c1-9-4-5-12(10(2)6-9)20-8-13-17-18-14(19)7-11(3)16-15(18)21-13/h4-7H,8H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76E+3	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
					More data for this Ligand-Target Pair
Xanthine dehydrogenase (Bos taurus (Bovine))	BDBM50333146 (2-((2,4-dimethylphenoxy)methyl)-7-methyl-5H-[1,3,4...) Show SMILES Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)c(C)c1 Show InChI InChI=1S/C15H15N3O2S/c1-9-4-5-12(10(2)6-9)20-8-13-17-18-14(19)7-11(3)16-15(18)21-13/h4-7H,8H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of bovine milk 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
					More data for this Ligand-Target Pair