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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 = 'BDBM50027474'   
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


(Homo sapiens (Human))
BDBM50027474
PNG
(CHEMBL3335592)
Show SMILES Oc1ccc(\C=C\C(=O)c2cc(O)ccc2O)c(O)c1
Show InChI InChI=1S/C15H12O5/c16-10-4-6-14(19)12(7-10)13(18)5-2-9-1-3-11(17)8-15(9)20/h1-8,16-17,19-20H/b5-2+
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 3.30E+3n/an/an/an/a



Instituto de Qu£mica M£dica (IQM-CSIC)

Curated by ChEMBL


Assay Description
Positive allosteric modulation at human alpha7 nACHR expressed in Xenopus oocyte assessed as potentiation of 200 uM ACh-induced current at holding po...


Eur J Med Chem 86: 724-39 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.039
BindingDB Entry DOI: 10.7270/Q2PN977T
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Homo sapiens (Human))
BDBM50027474
PNG
(CHEMBL3335592)
Show SMILES Oc1ccc(\C=C\C(=O)c2cc(O)ccc2O)c(O)c1
Show InChI InChI=1S/C15H12O5/c16-10-4-6-14(19)12(7-10)13(18)5-2-9-1-3-11(17)8-15(9)20/h1-8,16-17,19-20H/b5-2+
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 1.25E+5n/an/an/an/a



Instituto de Qu£mica M£dica (IQM-CSIC)

Curated by ChEMBL


Assay Description
Positive allosteric modulation at human alpha7 nACHR expressed in Xenopus oocyte assessed as potentiation of ACh-induced current at holding potential...


Eur J Med Chem 86: 724-39 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.039
BindingDB Entry DOI: 10.7270/Q2PN977T
More data for this
Ligand-Target Pair