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BDBM50047705 CHEMBL3314845

SMILES: Fc1cncc(Oc2cncc(NC(=O)c3ccncn3)n2)c1

InChI Key: InChIKey=NSLVZCPGMVVFLI-UHFFFAOYSA-N

Data: 2 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 = 50047705   
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


(Rattus norvegicus (Rat))
BDBM50047705
PNG
(CHEMBL3314845)
Show SMILES Fc1cncc(Oc2cncc(NC(=O)c3ccncn3)n2)c1
Show InChI InChI=1S/C14H9FN6O2/c15-9-3-10(5-17-4-9)23-13-7-18-6-12(20-13)21-14(22)11-1-2-16-8-19-11/h1-8H,(H,20,21,22)
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulator activity at rat mGlu5 expressed in HEK293A cells assessed as reduction in glutamate-induced calcium mobilization


Bioorg Med Chem Lett 24: 3307-14 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.003
BindingDB Entry DOI: 10.7270/Q2ZW1NJP
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor


(Rattus norvegicus (Rat))
BDBM50047705
PNG
(CHEMBL3314845)
Show SMILES Fc1cncc(Oc2cncc(NC(=O)c3ccncn3)n2)c1
Show InChI InChI=1S/C14H9FN6O2/c15-9-3-10(5-17-4-9)23-13-7-18-6-12(20-13)21-14(22)11-1-2-16-8-19-11/h1-8H,(H,20,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a<3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulator activity at rat mGlu5 expressed in HEK293A cells assessed as reduction in glutamate-induced calcium mobilization


Bioorg Med Chem Lett 24: 3307-14 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.003
BindingDB Entry DOI: 10.7270/Q2ZW1NJP
More data for this
Ligand-Target Pair