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SMILES: Nc1cc(cc(c1)-n1nnc(n1)-c1ccccn1)C#N

InChI Key: InChIKey=AWXVABIRNCPSRZ-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50174208   
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))
BDBM50174208
PNG
(3-Amino-5-(5-pyridin-2-yl-tetrazol-2-yl)-benzonitr...)
Show SMILES Nc1cc(cc(c1)-n1nnc(n1)-c1ccccn1)C#N
Show InChI InChI=1S/C13H9N7/c14-8-9-5-10(15)7-11(6-9)20-18-13(17-19-20)12-3-1-2-4-16-12/h1-7H,15H2
PDB
MMDB

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PC sid
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Article
PubMed
95n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Ability to displace [3H]-3-methoxy-5-(pyridin-2-ylethynyl)pyridine from binding to metabotropic glutamate receptor 5 in rat cortical membranes


Bioorg Med Chem Lett 15: 5061-4 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.062
BindingDB Entry DOI: 10.7270/Q2GT5MQ0
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50174208
PNG
(3-Amino-5-(5-pyridin-2-yl-tetrazol-2-yl)-benzonitr...)
Show SMILES Nc1cc(cc(c1)-n1nnc(n1)-c1ccccn1)C#N
Show InChI InChI=1S/C13H9N7/c14-8-9-5-10(15)7-11(6-9)20-18-13(17-19-20)12-3-1-2-4-16-12/h1-7H,15H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 308n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro functional activity measured by changes in cytosolic [Ca2+] concentrations against rat metabotropic glutamate receptor 5


Bioorg Med Chem Lett 15: 5061-4 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.062
BindingDB Entry DOI: 10.7270/Q2GT5MQ0
More data for this
Ligand-Target Pair