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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 2' and Ligand = 'BDBM50372871'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50372871
PNG
(CHEMBL256011)
Show SMILES Fc1ccc(cc1)C#Cc1ccc2N=C(CC(=O)Nc2c1)c1cccc(c1)-n1ccnc1 |c:14|
Show InChI InChI=1S/C26H17FN4O/c27-21-9-6-18(7-10-21)4-5-19-8-11-23-25(14-19)30-26(32)16-24(29-23)20-2-1-3-22(15-20)31-13-12-28-17-31/h1-3,6-15,17H,16H2,(H,30,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]LY354740 from rat recombinant mGluR2 expressed in CHO cells


Bioorg Med Chem Lett 18: 1091-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.005
BindingDB Entry DOI: 10.7270/Q2VD7096
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50372871
PNG
(CHEMBL256011)
Show SMILES Fc1ccc(cc1)C#Cc1ccc2N=C(CC(=O)Nc2c1)c1cccc(c1)-n1ccnc1 |c:14|
Show InChI InChI=1S/C26H17FN4O/c27-21-9-6-18(7-10-21)4-5-19-8-11-23-25(14-19)30-26(32)16-24(29-23)20-2-1-3-22(15-20)31-13-12-28-17-31/h1-3,6-15,17H,16H2,(H,30,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGluR2 assessed as effect on (1S,3R)-ACPD-induced inhibition of forskolin-stimulated cAMP production


Bioorg Med Chem Lett 18: 1091-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.005
BindingDB Entry DOI: 10.7270/Q2VD7096
More data for this
Ligand-Target Pair