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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 Monomerid = 50215453   
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


(Homo sapiens (Human))
BDBM50215453
PNG
(3-(2-(2,5-dimethylphenyl)ethynyl)-5-methyl-1,2,4-t...)
Show SMILES Cc1ccc(C)c(c1)C#Cc1nncc(C)n1
Show InChI InChI=1S/C14H13N3/c1-10-4-5-11(2)13(8-10)6-7-14-16-12(3)9-15-17-14/h4-5,8-9H,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.89E+3n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in CHOK1 cells assessed as inhibition of glutamate-mediated internal calcium mobilization


J Med Chem 50: 3388-91 (2007)


Article DOI: 10.1021/jm070078r
BindingDB Entry DOI: 10.7270/Q2Z89C3C
More data for this
Ligand-Target Pair