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Compile Data Set for Download or QSAR

Found 8 hits of ec50 for UniProtKB: P30532   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445605
PNG
(CHEMBL3104001)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C13H8N4O3/c18-17(19)11-5-1-3-9(7-11)13-15-12(16-20-13)10-4-2-6-14-8-10/h1-8H
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n/an/an/an/a 690n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445612
PNG
(CHEMBL3103985)
Show SMILES c1cncc(c1)-c1nnn(n1)-c1cccnc1
Show InChI InChI=1S/C11H8N6/c1-3-9(7-12-5-1)11-14-16-17(15-11)10-4-2-6-13-8-10/h1-8H
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n/an/an/an/a 700n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445611
PNG
(CHEMBL3103988)
Show SMILES N#Cc1cccc(c1)-c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C14H8N4O/c15-8-10-3-1-4-11(7-10)14-17-13(18-19-14)12-5-2-6-16-9-12/h1-7,9H
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MCE
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n/an/an/an/a 790n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445610
PNG
(CHEMBL3104068)
Show SMILES c1cncc(c1)-c1noc(n1)-c1cccnc1
Show InChI InChI=1S/C12H8N4O/c1-3-9(7-13-5-1)11-15-12(17-16-11)10-4-2-6-14-8-10/h1-8H
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n/an/an/an/a 1.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445609
PNG
(CHEMBL3103999)
Show SMILES Fc1ccc(cc1F)-c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C13H7F2N3O/c14-10-4-3-8(6-11(10)15)13-17-12(18-19-13)9-2-1-5-16-7-9/h1-7H
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n/an/an/an/a 1.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445608
PNG
(CHEMBL3104126)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C13H8N4O3/c18-17(19)11-5-3-9(4-6-11)13-15-12(16-20-13)10-2-1-7-14-8-10/h1-8H
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n/an/an/an/a 1.70E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445607
PNG
(CHEMBL3104079)
Show SMILES N#Cc1cccc(c1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C13H8N6/c14-8-10-3-1-5-12(7-10)19-17-13(16-18-19)11-4-2-6-15-9-11/h1-7,9H
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antibodypedia
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Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/alpha-5/beta-2


(Homo sapiens (Human))
BDBM50445606
PNG
(CHEMBL3103983)
Show SMILES N#Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C13H8N6/c14-8-10-3-5-12(6-4-10)19-17-13(16-18-19)11-2-1-7-15-9-11/h1-7,9H
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/an/a 2.20E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human alpha4beta2alpha5 nACHR expressed in HEK-tsA201 cells assessed as potentiation of nicotine-induced current pr...


Bioorg Med Chem Lett 24: 674-8 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.049
BindingDB Entry DOI: 10.7270/Q2RF5WH9
More data for this
Ligand-Target Pair