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PubMed code 18789861

Compile data set for download or QSAR
Found 26 hits of Enzyme Inhibition Constant Data   
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))		BDBM50264764
PNG
(3-(2,6-dichlorophenyl)-5-(1-(piperidin-4-yl)-1H-py...)
Show SMILES Clc1cccc(Cl)c1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H16Cl2N4O/c18-13-2-1-3-14(19)17(13)15-8-16(24-22-15)11-9-21-23(10-11)12-4-6-20-7-5-12/h1-3,8-10,12,20H,4-7H2
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n/an/an/an/a 410n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264801
PNG
(3-(2-chloro-6-fluorophenyl)-5-(2-(4-fluoropiperidi...)
Show SMILES Cn1c(cnc1C1(F)CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C18H17ClF2N4O/c1-25-14(10-23-17(25)18(21)5-7-22-8-6-18)15-9-13(24-26-15)16-11(19)3-2-4-12(16)20/h2-4,9-10,22H,5-8H2,1H3
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n/an/an/an/a 34n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264798
PNG
(3-(2-chlorophenyl)-5-(2-(piperidin-4-yl)thiazol-5-...)
Show SMILES Clc1ccccc1-c1cc(on1)-c1cnc(s1)C1CCNCC1
Show InChI InChI=1S/C17H16ClN3OS/c18-13-4-2-1-3-12(13)14-9-15(22-21-14)16-10-20-17(23-16)11-5-7-19-8-6-11/h1-4,9-11,19H,5-8H2
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n/an/an/an/a 33n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264882
PNG
(CHEMBL497990 | N-((3-(2-chlorophenyl)isoxazol-5-yl...)
Show SMILES CN(Cc1cc(no1)-c1ccccc1Cl)C(=O)C1CCNCC1
Show InChI InChI=1S/C17H20ClN3O2/c1-21(17(22)12-6-8-19-9-7-12)11-13-10-16(20-23-13)14-4-2-3-5-15(14)18/h2-5,10,12,19H,6-9,11H2,1H3
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n/an/an/an/a 350n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264918
PNG
(3-(2-chloro-5-fluorophenyl)-5-(1-(piperidin-4-yl)-...)
Show SMILES Fc1ccc(Cl)c(c1)-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H16ClFN4O/c18-15-2-1-12(19)7-14(15)16-8-17(24-22-16)11-9-21-23(10-11)13-3-5-20-6-4-13/h1-2,7-10,13,20H,3-6H2
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n/an/an/an/a 270n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264919
PNG
(3-(2-chloro-4-fluorophenyl)-5-(1-(piperidin-4-yl)-...)
Show SMILES Fc1ccc(-c2cc(on2)-c2cnn(c2)C2CCNCC2)c(Cl)c1
Show InChI InChI=1S/C17H16ClFN4O/c18-15-7-12(19)1-2-14(15)16-8-17(24-22-16)11-9-21-23(10-11)13-3-5-20-6-4-13/h1-2,7-10,13,20H,3-6H2
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n/an/an/an/a 220n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264797
PNG
(3-cyclohexyl-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl...)
Show SMILES C1CCC(CC1)c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H24N4O/c1-2-4-13(5-3-1)16-10-17(22-20-16)14-11-19-21(12-14)15-6-8-18-9-7-15/h10-13,15,18H,1-9H2
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n/an/an/an/a 4.60E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3


(Homo sapiens (Human))		BDBM50264883
PNG
(3-(2-chlorophenyl)-5-(1-(piperidin-4-yl)-1H-pyrazo...)
Show SMILES Clc1ccccc1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H17ClN4O/c18-15-4-2-1-3-14(15)16-9-17(23-21-16)12-10-20-22(11-12)13-5-7-19-8-6-13/h1-4,9-11,13,19H,5-8H2
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n/an/an/an/a>1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha3beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264914
PNG
(3-phenyl-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)iso...)
Show SMILES C1CC(CCN1)n1cc(cn1)-c1cc(no1)-c1ccccc1
Show InChI InChI=1S/C17H18N4O/c1-2-4-13(5-3-1)16-10-17(22-20-16)14-11-19-21(12-14)15-6-8-18-9-7-15/h1-5,10-12,15,18H,6-9H2
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n/an/an/an/a 1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264917
PNG
(3-(2-chloro-6-fluorophenyl)-5-(5-methyl-1-(piperid...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C18H18ClFN4O/c1-11-13(10-22-24(11)12-5-7-21-8-6-12)17-9-16(23-25-17)18-14(19)3-2-4-15(18)20/h2-4,9-10,12,21H,5-8H2,1H3
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n/an/an/an/a 6n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264799
PNG
(3-(2-chloro-6-fluorophenyl)-5-(1-methyl-2-(piperid...)
Show SMILES Cn1c(cnc1C1CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C18H18ClFN4O/c1-24-15(10-22-18(24)11-5-7-21-8-6-11)16-9-14(23-25-16)17-12(19)3-2-4-13(17)20/h2-4,9-11,21H,5-8H2,1H3
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n/an/an/an/a 12n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264920
PNG
(3-(2-chloro-6-fluorophenyl)-5-(1-ethyl-2-(4-fluoro...)
Show SMILES CCn1c(cnc1C1(F)CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C19H19ClF2N4O/c1-2-26-15(11-24-18(26)19(22)6-8-23-9-7-19)16-10-14(25-27-16)17-12(20)4-3-5-13(17)21/h3-5,10-11,23H,2,6-9H2,1H3
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n/an/an/an/a 3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3


(Homo sapiens (Human))		BDBM50264883
PNG
(3-(2-chlorophenyl)-5-(1-(piperidin-4-yl)-1H-pyrazo...)
Show SMILES Clc1ccccc1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H17ClN4O/c18-15-4-2-1-3-14(15)16-9-17(23-21-16)12-10-20-22(11-12)13-5-7-19-8-6-13/h1-4,9-11,13,19H,5-8H2
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n/an/an/an/a>1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha3beta4 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Rattus norvegicus (Rat))		BDBM50264884
PNG
(3-(2-chlorophenyl)-5-(5-methyl-1-(piperidin-4-yl)-...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1Cl
Show InChI InChI=1S/C18H19ClN4O/c1-12-15(11-21-23(12)13-6-8-20-9-7-13)18-10-17(22-24-18)14-4-2-3-5-16(14)19/h2-5,10-11,13,20H,6-9H2,1H3
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n/an/an/an/a 20n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of rat alpha4beta2 nAChR by fluorescence assay

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264765
PNG
(3-methyl-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)iso...)
Show SMILES Cc1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C12H16N4O/c1-9-6-12(17-15-9)10-7-14-16(8-10)11-2-4-13-5-3-11/h6-8,11,13H,2-5H2,1H3
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n/an/an/an/a 1.30E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264915
PNG
(5-(5-methyl-1-(piperidin-4-yl)-1H-pyrazol-4-yl)-3-...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1
Show InChI InChI=1S/C18H20N4O/c1-13-16(12-20-22(13)15-7-9-19-10-8-15)18-11-17(21-23-18)14-5-3-2-4-6-14/h2-6,11-12,15,19H,7-10H2,1H3
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n/an/an/an/a 1.20E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264916
PNG
(3-(2-chloro-6-fluorophenyl)-5-(1-(piperidin-4-yl)-...)
Show SMILES Fc1cccc(Cl)c1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H16ClFN4O/c18-13-2-1-3-14(19)17(13)15-8-16(24-22-15)11-9-21-23(10-11)12-4-6-20-7-5-12/h1-3,8-10,12,20H,4-7H2
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n/an/an/an/a 48n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264763
PNG
(3-(2-chlorothiophen-3-yl)-5-(1-(piperidin-4-yl)-1H...)
Show SMILES Clc1sccc1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C15H15ClN4OS/c16-15-12(3-6-22-15)13-7-14(21-19-13)10-8-18-20(9-10)11-1-4-17-5-2-11/h3,6-9,11,17H,1-2,4-5H2
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n/an/an/an/a 130n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3


(Homo sapiens (Human))		BDBM50264882
PNG
(CHEMBL497990 | N-((3-(2-chlorophenyl)isoxazol-5-yl...)
Show SMILES CN(Cc1cc(no1)-c1ccccc1Cl)C(=O)C1CCNCC1
Show InChI InChI=1S/C17H20ClN3O2/c1-21(17(22)12-6-8-19-9-7-12)11-13-10-16(20-23-13)14-4-2-3-5-15(14)18/h2-5,10,12,19H,6-9,11H2,1H3
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n/an/an/an/a>1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha3beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3


(Homo sapiens (Human))		BDBM50264882
PNG
(CHEMBL497990 | N-((3-(2-chlorophenyl)isoxazol-5-yl...)
Show SMILES CN(Cc1cc(no1)-c1ccccc1Cl)C(=O)C1CCNCC1
Show InChI InChI=1S/C17H20ClN3O2/c1-21(17(22)12-6-8-19-9-7-12)11-13-10-16(20-23-13)14-4-2-3-5-15(14)18/h2-5,10,12,19H,6-9,11H2,1H3
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n/an/an/an/a>1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha3beta4 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Homo sapiens (Human))		BDBM50264884
PNG
(3-(2-chlorophenyl)-5-(5-methyl-1-(piperidin-4-yl)-...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1Cl
Show InChI InChI=1S/C18H19ClN4O/c1-12-15(11-21-23(12)13-6-8-20-9-7-13)18-10-17(22-24-18)14-4-2-3-5-16(14)19/h2-5,10-11,13,20H,6-9H2,1H3
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n/an/an/an/a>1.00E+5n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha7 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264883
PNG
(3-(2-chlorophenyl)-5-(1-(piperidin-4-yl)-1H-pyrazo...)
Show SMILES Clc1ccccc1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C17H17ClN4O/c18-15-4-2-1-3-14(15)16-9-17(23-21-16)12-10-20-22(11-12)13-5-7-19-8-6-13/h1-4,9-11,13,19H,5-8H2
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n/an/an/an/a 120n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264761
PNG
(3-(2-chloro-3-fluorophenyl)-5-(1-(piperidin-4-yl)-...)
Show SMILES Fc1cccc(-c2cc(on2)-c2cnn(c2)C2CCNCC2)c1Cl
Show InChI InChI=1S/C17H16ClFN4O/c18-17-13(2-1-3-14(17)19)15-8-16(24-22-15)11-9-21-23(10-11)12-4-6-20-7-5-12/h1-3,8-10,12,20H,4-7H2
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n/an/an/an/a 230n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264762
PNG
(3-(3-chloropyridin-4-yl)-5-(1-(piperidin-4-yl)-1H-...)
Show SMILES Clc1cnccc1-c1cc(on1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C16H16ClN5O/c17-14-9-19-6-3-13(14)15-7-16(23-21-15)11-8-20-22(10-11)12-1-4-18-5-2-12/h3,6-10,12,18H,1-2,4-5H2
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n/an/an/an/a 200n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264800
PNG
(3-(2-chloro-6-fluorophenyl)-5-(1-ethyl-2-(piperidi...)
Show SMILES CCn1c(cnc1C1CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C19H20ClFN4O/c1-2-25-16(11-23-19(25)12-6-8-22-9-7-12)17-10-15(24-26-17)18-13(20)4-3-5-14(18)21/h3-5,10-12,22H,2,6-9H2,1H3
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n/an/an/an/a 3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4


(Homo sapiens (Human))		BDBM50264884
PNG
(3-(2-chlorophenyl)-5-(5-methyl-1-(piperidin-4-yl)-...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1ccccc1Cl
Show InChI InChI=1S/C18H19ClN4O/c1-12-15(11-21-23(12)13-6-8-20-9-7-13)18-10-17(22-24-18)14-4-2-3-5-16(14)19/h2-5,10-11,13,20H,6-9H2,1H3
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n/an/an/an/a 18n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current

Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%