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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 = 50327688   
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))
BDBM50327688
PNG
(3-Fluoro-5-(2-(pyridin-2-yl)-6,7-dihydrooxazolo[4,...)
Show SMILES Fc1cc(cc(c1)N1CCc2oc(nc2C1)-c1ccccn1)C#N
Show InChI InChI=1S/C18H13FN4O/c19-13-7-12(10-20)8-14(9-13)23-6-4-17-16(11-23)22-18(24-17)15-3-1-2-5-21-15/h1-3,5,7-9H,4,6,11H2
PDB
MMDB

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Article
PubMed
n/an/a 28n/an/an/an/an/an/a



Sepracor Inc.

Curated by ChEMBL


Assay Description
Modulation of human recombinant mGluR5 expressed in CHO cells assessed as inhibition of glutamate-induced response


J Med Chem 53: 7107-18 (2010)


Article DOI: 10.1021/jm100736h
BindingDB Entry DOI: 10.7270/Q20G3KCJ
More data for this
Ligand-Target Pair