BDBM50162572 6,7-Dichloro-2-cyclopentyl-5-[3-(pyridin-4-ylsulfanylmethyl)-benzyloxy]-indan-1-one::CHEMBL179839

SMILES: Clc1c2C(=O)C(Cc2cc(OCc2cccc(CSc3ccncc3)c2)c1Cl)C1CCCC1

InChI Key: InChIKey=XMYHKZONDUFBIM-UHFFFAOYSA-N

Data: 1 EC50

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 = 50162572   

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 2 (Homo sapiens (Human))	BDBM50162572 (6,7-Dichloro-2-cyclopentyl-5-[3-(pyridin-4-ylsulfa...) Show SMILES Clc1c2C(=O)C(Cc2cc(OCc2cccc(CSc3ccncc3)c2)c1Cl)C1CCCC1 Show InChI InChI=1S/C27H25Cl2NO2S/c28-25-23(14-20-13-22(19-6-1-2-7-19)27(31)24(20)26(25)29)32-15-17-4-3-5-18(12-17)16-33-21-8-10-30-11-9-21/h3-5,8-12,14,19,22H,1-2,6-7,13,15-16H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	165	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity against metabotropic glutamate receptor 2				Bioorg Med Chem Lett 15: 1565-71 (2005) Article DOI: 10.1016/j.bmcl.2005.01.077 BindingDB Entry DOI: 10.7270/Q2XW4JBK
					More data for this Ligand-Target Pair