new BindingDB logo
myBDB logout
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 = 'BDBM50418477'   
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))
BDBM50418477
PNG
(CHEMBL1783277)
Show SMILES COc1ccc(OC)c(c1)-c1c(F)ccc2c(N)c3c(cn(C4CC4)c3=O)[nH]c12 |(23.23,-49.55,;23.23,-48.01,;21.89,-47.25,;20.55,-48.02,;19.22,-47.25,;19.22,-45.71,;17.9,-44.93,;16.56,-45.7,;20.56,-44.95,;21.89,-45.71,;20.56,-43.41,;19.23,-42.64,;17.9,-43.41,;19.23,-41.1,;20.56,-40.33,;21.9,-41.09,;23.23,-40.3,;23.22,-38.77,;24.6,-41.08,;24.59,-42.64,;26.07,-43.13,;26.99,-41.88,;28.53,-41.89,;29.86,-42.66,;29.87,-41.12,;26.08,-40.61,;26.57,-39.15,;23.24,-43.41,;21.9,-42.65,)|
Show InChI InChI=1S/C22H20FN3O3/c1-28-12-5-8-17(29-2)14(9-12)18-15(23)7-6-13-20(24)19-16(25-21(13)18)10-26(22(19)27)11-3-4-11/h5-11,25H,3-4,24H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
13.8n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]flunitrazepam from benzodiazepine binding site GABAA alpha2beta3gamma2 receptor expressed in Sf9 cells after 1 hr


Bioorg Med Chem 19: 2927-38 (2011)


Article DOI: 10.1016/j.bmc.2011.03.035
BindingDB Entry DOI: 10.7270/Q29S1S98
More data for this
Ligand-Target Pair