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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit alpha-7' and Ligand = 'BDBM50320545'   
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
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50320545
PNG
(3-(2-acetoxylbenzylidine)anabasaine | CHEMBL116521...)
Show SMILES CC(=O)Oc1ccccc1\C=C1/CCCN=C1c1cccnc1 |c:16|
Show InChI InChI=1S/C19H18N2O2/c1-14(22)23-18-9-3-2-6-15(18)12-16-7-5-11-21-19(16)17-8-4-10-20-13-17/h2-4,6,8-10,12-13H,5,7,11H2,1H3/b16-12+
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
244n/an/an/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat brain membrane after 3 hrs


Eur J Med Chem 45: 2433-46 (2010)


Article DOI: 10.1016/j.ejmech.2010.02.027
BindingDB Entry DOI: 10.7270/Q27081M9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50320545
PNG
(3-(2-acetoxylbenzylidine)anabasaine | CHEMBL116521...)
Show SMILES CC(=O)Oc1ccccc1\C=C1/CCCN=C1c1cccnc1 |c:16|
Show InChI InChI=1S/C19H18N2O2/c1-14(22)23-18-9-3-2-6-15(18)12-16-7-5-11-21-19(16)17-8-4-10-20-13-17/h2-4,6,8-10,12-13H,5,7,11H2,1H3/b16-12+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
244n/an/an/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat brain membrane after 3 hrs


Eur J Med Chem 45: 2433-46 (2010)


Article DOI: 10.1016/j.ejmech.2010.02.027
BindingDB Entry DOI: 10.7270/Q27081M9
More data for this
Ligand-Target Pair