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SMILES: Cc1cccc(n1)C#Cc1cncc(c1)-c1ccccc1

InChI Key: InChIKey=NYCKBHBDURYRAF-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50160633   
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 5


(Rattus norvegicus (Rat))
BDBM50160633
PNG
(2-methyl-6-[(5-phenylpyridin-3-yl)ethynyl]pyridine...)
Show SMILES Cc1cccc(n1)C#Cc1cncc(c1)-c1ccccc1
Show InChI InChI=1S/C19H14N2/c1-15-6-5-9-19(21-15)11-10-16-12-18(14-20-13-16)17-7-3-2-4-8-17/h2-9,12-14H,1H3
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.70n/an/an/an/an/an/an/an/a



Yale University

Curated by ChEMBL


Assay Description
In vitro binding affinity of compound towards rat metabotropic glutamate receptor 5 was determined using inositol phosphate hydrolysis assay


Bioorg Med Chem Lett 15: 945-9 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.047
BindingDB Entry DOI: 10.7270/Q2QN6681
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50160633
PNG
(2-methyl-6-[(5-phenylpyridin-3-yl)ethynyl]pyridine...)
Show SMILES Cc1cccc(n1)C#Cc1cncc(c1)-c1ccccc1
Show InChI InChI=1S/C19H14N2/c1-15-6-5-9-19(21-15)11-10-16-12-18(14-20-13-16)17-7-3-2-4-8-17/h2-9,12-14H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Yale University

Curated by ChEMBL


Assay Description
Concentration required for 50% growth inhibition of rat metabotropic glutamate receptor 5 was determined using inositol phosphate hydrolysis assay


Bioorg Med Chem Lett 15: 945-9 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.047
BindingDB Entry DOI: 10.7270/Q2QN6681
More data for this
Ligand-Target Pair