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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit beta-2' and Ligand = 'BDBM50006631'   
Target
(Institution)
LigandTarget
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
Neuronal acetylcholine receptor subunit beta-2


(Mus musculus)
BDBM50006631
PNG
(CHEMBL3235507)
Show SMILES COc1cc2CCN3CC[C@@H]4CCCC[C@]34c2cc1O
Show InChI InChI=1S/C17H23NO2/c1-20-16-10-12-5-8-18-9-6-13-4-2-3-7-17(13,18)14(12)11-15(16)19/h10-11,13,19H,2-9H2,1H3/t13-,17-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 2.90E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at mouse alpha4/beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced activity by FLIPR membrane p...


J Med Chem 56: 9673-82 (2014)

More data for this
Ligand-Target Pair