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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

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50162572   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50162572
PNG
(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

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/an/a 165n/an/an/an/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