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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM50151904'   
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))
BDBM50151904
PNG
(3-(2-Pyridin-2-yl-2H-[1,2,3]triazol-4-yl)-benzonit...)
Show SMILES N#Cc1cccc(c1)-c1cnn(n1)-c1ccccn1
Show InChI InChI=1S/C14H9N5/c15-9-11-4-3-5-12(8-11)13-10-17-19(18-13)14-6-1-2-7-16-14/h1-8,10H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
200n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-3-methoxy-5-(pyridin-2-ylethynyl)pyridine from glutamate 5 receptor of rat cortical membranes


J Med Chem 47: 4645-8 (2004)


Article DOI: 10.1021/jm049828c
BindingDB Entry DOI: 10.7270/Q2DJ5F3G
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50151904
PNG
(3-(2-Pyridin-2-yl-2H-[1,2,3]triazol-4-yl)-benzonit...)
Show SMILES N#Cc1cccc(c1)-c1cnn(n1)-c1ccccn1
Show InChI InChI=1S/C14H9N5/c15-9-11-4-3-5-12(8-11)13-10-17-19(18-13)14-6-1-2-7-16-14/h1-8,10H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 210n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration towards human glutamate receptor 5 in calcium flux assay


J Med Chem 47: 4645-8 (2004)


Article DOI: 10.1021/jm049828c
BindingDB Entry DOI: 10.7270/Q2DJ5F3G
More data for this
Ligand-Target Pair