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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 382.8
BDBM206766

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

Found 1 hit 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 1


(Homo sapiens (Human))
BDBM206766
PNG
(US9260448, 68)
Show SMILES Clc1ccc(cc1)-n1cnc2c(csc2c1=O)-c1ccc2OCOc2c1
Show InChI InChI=1S/C19H11ClN2O3S/c20-12-2-4-13(5-3-12)22-9-21-17-14(8-26-18(17)19(22)23)11-1-6-15-16(7-11)25-10-24-15/h1-9H,10H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 447n/an/an/an/an/an/a



KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY

US Patent


Assay Description
Cells of Chem3 Cell Line (HTS145C:Millipore) in which mGluR1 was stably expressed were adjusted to a density of 2×106/ml. 50 μl of the cells wer...


US Patent US9260448 (2016)


BindingDB Entry DOI: 10.7270/Q2H9941W
More data for this
Ligand-Target Pair