BDBM109164 US8609852, 71

SMILES: COCc1ccccc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1

InChI Key: InChIKey=PCPBBAXMWGOZJC-UHFFFAOYSA-O

Data: 1 KI

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 = 109164   

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
Metabotropic glutamate receptor 5 (Rattus norvegicus (Rat))	BDBM109164 (US8609852, 71) Show SMILES COCc1ccccc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1 Show InChI InChI=1S/C19H16N2OS/c1-14-21-17(13-23-14)9-7-15-8-10-19(20-11-15)18-6-4-3-5-16(18)12-22-2/h3-6,8,10-11,13H,12H2,1-2H3/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	4.5	-11.4	n/a	n/a	n/a	n/a	n/a	n/a	25
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...				US Patent US8609852 (2013) BindingDB Entry DOI: 10.7270/Q27M06K3
					More data for this Ligand-Target Pair