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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-4' and Ligand = 'BDBM50397892'   
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-4


(Homo sapiens (Human))
BDBM50397892
PNG
(CHEMBL2179527)
Show SMILES Fc1coc(c1)C(=O)N1CC2CNCC2C1
Show InChI InChI=1S/C11H13FN2O2/c12-9-1-10(16-6-9)11(15)14-4-7-2-13-3-8(7)5-14/h1,6-8,13H,2-5H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
21 -43.2n/an/an/an/an/an/a21



Targacept, Inc.

US Patent


Assay Description
The binding of [3H]MLA was measured using a modification of the methods of Davies et al., Neuropharmacol. 38: 679 (1999). [3H]MLA (Specific Activity=...


US Patent US8921410 (2014)


BindingDB Entry DOI: 10.7270/Q2QZ28PT
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Rattus norvegicus (Rat))
BDBM50397892
PNG
(CHEMBL2179527)
Show SMILES Fc1coc(c1)C(=O)N1CC2CNCC2C1
Show InChI InChI=1S/C11H13FN2O2/c12-9-1-10(16-6-9)11(15)14-4-7-2-13-3-8(7)5-14/h1,6-8,13H,2-5H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
36 -41.9n/an/an/an/an/an/a21



Targacept, Inc.

US Patent


Assay Description
The binding of [3H]MLA was measured using a modification of the methods of Davies et al., Neuropharmacol. 38: 679 (1999). [3H]MLA (Specific Activity=...


US Patent US8921410 (2014)


BindingDB Entry DOI: 10.7270/Q2QZ28PT
More data for this
Ligand-Target Pair