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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'GABA receptor alpha-2/beta-3/gamma-2 subunit' and Ligand = 'BDBM50149421'   
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
GABA receptor alpha-2/beta-3/gamma-2 subunit


(Homo sapiens (Human))
BDBM50149421
PNG
(6-methyl-2-pyridyl[6-(1-methyl-1H-1,2,4-triazol-3-...)
Show SMILES Cc1cccc(COc2nn3c(nnc3c3C4CCC(CC4)c23)-c2ncn(C)n2)n1
Show InChI InChI=1S/C21H22N8O/c1-12-4-3-5-15(23-12)10-30-21-17-14-8-6-13(7-9-14)16(17)19-24-25-20(29(19)27-21)18-22-11-28(2)26-18/h3-5,11,13-14H,6-10H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards human gamma-aminobutyric-acid A receptor alpha2-beta3-gamma2 using [3H]-Ro-15-1788 expressed in L(tk-) cells


J Med Chem 47: 3642-57 (2004)


Article DOI: 10.1021/jm0407613
BindingDB Entry DOI: 10.7270/Q2RB7423
More data for this
Ligand-Target Pair