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BDBM50416276 CHEMBL1082975

SMILES: Cc1cccc(c1)-n1nnc(n1)C1CCCCN1C(=O)C1CCC1

InChI Key: InChIKey=JYKXKWCFKDKPBL-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 = 50416276   
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))
BDBM50416276
PNG
(CHEMBL1082975)
Show SMILES Cc1cccc(c1)-n1nnc(n1)C1CCCCN1C(=O)C1CCC1
Show InChI InChI=1S/C18H23N5O/c1-13-6-4-9-15(12-13)23-20-17(19-21-23)16-10-2-3-11-22(16)18(24)14-7-5-8-14/h4,6,9,12,14,16H,2-3,5,7-8,10-11H2,1H3
PDB
MMDB

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UniProtKB/TrEMBL

B.MOAD
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
72.4n/an/an/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Displacement of [3H]-M-MPEP from mGluR5 in rat cerebrocortical membranes


Bioorg Med Chem Lett 20: 3737-41 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.075
BindingDB Entry DOI: 10.7270/Q2FX7BPQ
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor


(Rattus norvegicus (Rat))
BDBM50416276
PNG
(CHEMBL1082975)
Show SMILES Cc1cccc(c1)-n1nnc(n1)C1CCCCN1C(=O)C1CCC1
Show InChI InChI=1S/C18H23N5O/c1-13-6-4-9-15(12-13)23-20-17(19-21-23)16-10-2-3-11-22(16)18(24)14-7-5-8-14/h4,6,9,12,14,16H,2-3,5,7-8,10-11H2,1H3
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 224n/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Allosteric modulation of mGluR5 in E17 rat neuronal cultures assessed as inhibition of (S)-3,5-dihydroxyphenylglycine-induced calcium level


Bioorg Med Chem Lett 20: 3737-41 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.075
BindingDB Entry DOI: 10.7270/Q2FX7BPQ
More data for this
Ligand-Target Pair