BDBM352057 US9802907, Compound 42

SMILES: Cc1nc([se]c1C(O)=O)-c1ccc(SCc2ccccc2)c(c1)C#N

InChI Key: InChIKey=ISFYDGWZVFOSLF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 352057   

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 oxidase (Homo sapiens (Human))	BDBM352057 (US9802907, Compound 42) Show SMILES Cc1nc([se]c1C(O)=O)-c1ccc(SCc2ccccc2)c(c1)C#N Show InChI InChI=1S/C19H14N2O2SSe/c1-12-17(19(22)23)25-18(21-12)14-7-8-16(15(9-14)10-20)24-11-13-5-3-2-4-6-13/h2-9H,11H2,1H3,(H,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.07	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU ATOM BIOSCIENCE AND PHARMACEUTICAL CO., LTD. US Patent					Assay Description The inhibition of the activity of xanthine oxidase (XO) is tested through a coupled enzymatic reaction of xanthine oxidase, horseradish peroxidase (H...				US Patent US9802907 (2017) BindingDB Entry DOI: 10.7270/Q2PN97S0
					More data for this Ligand-Target Pair