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BDBM50317854 5-((6-Methylpyridin-2-yl)ethynyl)nicotinonitrile::CHEMBL1098656

SMILES: Cc1cccc(n1)C#Cc1cncc(c1)C#N

InChI Key: InChIKey=ZWOWJRDKGWIZDL-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50317854   
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))
BDBM50317854
PNG
(5-((6-Methylpyridin-2-yl)ethynyl)nicotinonitrile |...)
Show SMILES Cc1cccc(n1)C#Cc1cncc(c1)C#N
Show InChI InChI=1S/C14H9N3/c1-11-3-2-4-14(17-11)6-5-12-7-13(8-15)10-16-9-12/h2-4,7,9-10H,1H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3HMPEP from rat cloned mGluR5 expressed in HEK293T cells by by scintillation counting


Bioorg Med Chem 18: 3026-35 (2010)


Article DOI: 10.1016/j.bmc.2010.03.053
BindingDB Entry DOI: 10.7270/Q29C6XK8
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50317854
PNG
(5-((6-Methylpyridin-2-yl)ethynyl)nicotinonitrile |...)
Show SMILES Cc1cccc(n1)C#Cc1cncc(c1)C#N
Show InChI InChI=1S/C14H9N3/c1-11-3-2-4-14(17-11)6-5-12-7-13(8-15)10-16-9-12/h2-4,7,9-10H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGluR5 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium flux preincubated for 140 secs befor...


Bioorg Med Chem 18: 3026-35 (2010)


Article DOI: 10.1016/j.bmc.2010.03.053
BindingDB Entry DOI: 10.7270/Q29C6XK8
More data for this
Ligand-Target Pair