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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 3' and Ligand = 'BDBM393826'   
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 3


(Rattus norvegicus (Rat))
BDBM393826
PNG
(US10597367, Example 114 | US9969726, Example 114)
Show SMILES OC(=O)c1ccc(F)c(c1)-c1cccc(c1)-c1nc(cc(n1)C(F)(F)F)-c1ccoc1
Show InChI InChI=1S/C22H12F4N2O3/c23-17-5-4-14(21(29)30)9-16(17)12-2-1-3-13(8-12)20-27-18(15-6-7-31-11-15)10-19(28-20)22(24,25)26/h1-11H,(H,29,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 140n/an/an/an/a



Universita degli Studi di Roma La Sapienza



Assay Description
Human Embryonic Kidney (HEK-293) cell lines co-expressing rat mGlu receptors 2, 3, 4, 6, 7 or 8 and G protein-coupled inwardly-rectifying potassium (...


J Med Chem 52: 1935-42 (2009)


BindingDB Entry DOI: 10.7270/Q2RX9FDX
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 3


(Rattus norvegicus (Rat))
BDBM393826
PNG
(US10597367, Example 114 | US9969726, Example 114)
Show SMILES OC(=O)c1ccc(F)c(c1)-c1cccc(c1)-c1nc(cc(n1)C(F)(F)F)-c1ccoc1
Show InChI InChI=1S/C22H12F4N2O3/c23-17-5-4-14(21(29)30)9-16(17)12-2-1-3-13(8-12)20-27-18(15-6-7-31-11-15)10-19(28-20)22(24,25)26/h1-11H,(H,29,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.36E+3n/an/an/an/a



Universita degli Studi di Roma La Sapienza



Assay Description
Human Embryonic Kidney (HEK-293) cell lines co-expressing rat mGlu receptors 2, 3, 4, 6, 7 or 8 and G protein-coupled inwardly-rectifying potassium (...


J Med Chem 52: 1935-42 (2009)


BindingDB Entry DOI: 10.7270/Q2RX9FDX
More data for this
Ligand-Target Pair