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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM50312134'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50312134
PNG
(3-chloro-N-(3-(cyclopropanecarboxamido)phenyl)benz...)
Show SMILES Clc1cccc(c1)C(=O)Nc1cccc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C17H15ClN2O2/c18-13-4-1-3-12(9-13)17(22)20-15-6-2-5-14(10-15)19-16(21)11-7-8-11/h1-6,9-11H,7-8H2,(H,19,21)(H,20,22)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 2.23E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGluR5 expressed in human HEK293A cells assessed as inhibition of glutamate-induced calcium flux


Bioorg Med Chem Lett 19: 6502-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.059
BindingDB Entry DOI: 10.7270/Q2JD4WZJ
More data for this
Ligand-Target Pair