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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 326.3
BDBM417078

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   
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))
BDBM417078
PNG
(2-(4-Fluorophenyl)-5-(2-phenoxyethoxy)pyridazin-3(...)
Show SMILES Fc1ccc(cc1)-n1ncc(OCCOc2ccccc2)cc1=O
Show InChI InChI=1S/C18H15FN2O3/c19-14-6-8-15(9-7-14)21-18(22)12-17(13-20-21)24-11-10-23-16-4-2-1-3-5-16/h1-9,12-13H,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.87E+3n/an/an/an/an/an/a



Vanderbilt University

US Patent


Assay Description
Gα15/TREx cells stably expressing rat mGlu3 were plated in black-walled, clear-bottomed, poly-D-lysine coated 384-well plates in 20 μL of a...


US Patent US10399948 (2019)


BindingDB Entry DOI: 10.7270/Q2794726
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM417078
PNG
(2-(4-Fluorophenyl)-5-(2-phenoxyethoxy)pyridazin-3(...)
Show SMILES Fc1ccc(cc1)-n1ncc(OCCOc2ccccc2)cc1=O
Show InChI InChI=1S/C18H15FN2O3/c19-14-6-8-15(9-7-14)21-18(22)12-17(13-20-21)24-11-10-23-16-4-2-1-3-5-16/h1-9,12-13H,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University

US Patent


Assay Description
Gα15 HEK293 cells stably expressing rat mGlu2 were plated in black-walled, clear-bottomed, poly-D-lysine coated 384-well plates in 20 μL of...


US Patent US10399948 (2019)


BindingDB Entry DOI: 10.7270/Q2794726
More data for this
Ligand-Target Pair