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PubMed code 11266158

Compile data set for download or QSAR
Found 29 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/beta-2


(Rattus norvegicus (Rat))		BDBM50097597
PNG
(3-(3-Chloro-4-fluoro-phenyl)-5-((S)-1-methyl-pyrro...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(F)c(Cl)c1
Show InChI InChI=1S/C17H18ClFN2O/c1-21-6-2-3-14(21)11-22-15-7-13(9-20-10-15)12-4-5-17(19)16(18)8-12/h4-5,7-10,14H,2-3,6,11H2,1H3/t14-/m0/s1
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 0.0550n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097617
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-(2-pyrid...)
Show SMILES CN1CCC[C@H]1COc1cncc(CCc2ccncc2)c1
Show InChI InChI=1S/C18H23N3O/c1-21-10-2-3-17(21)14-22-18-11-16(12-20-13-18)5-4-15-6-8-19-9-7-15/h6-9,11-13,17H,2-5,10,14H2,1H3/t17-/m0/s1
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 0.0640n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097608
PNG
(3-(4-Chloro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-y...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C17H19ClN2O/c1-20-8-2-3-16(20)12-21-17-9-14(10-19-11-17)13-4-6-15(18)7-5-13/h4-7,9-11,16H,2-3,8,12H2,1H3/t16-/m0/s1
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 0.0820n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097606
PNG
(3-(4-Fluoro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-y...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H19FN2O/c1-20-8-2-3-16(20)12-21-17-9-14(10-19-11-17)13-4-6-15(18)7-5-13/h4-7,9-11,16H,2-3,8,12H2,1H3/t16-/m0/s1
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 0.110n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097618
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-phenyl-p...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccccc1
Show InChI InChI=1S/C17H20N2O/c1-19-9-5-8-16(19)13-20-17-10-15(11-18-12-17)14-6-3-2-4-7-14/h2-4,6-7,10-12,16H,5,8-9,13H2,1H3/t16-/m0/s1
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 0.110n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097596
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-((E)-2-p...)
Show SMILES CN1CCC[C@H]1COc1cncc(\C=C\c2ccncc2)c1
Show InChI InChI=1S/C18H21N3O/c1-21-10-2-3-17(21)14-22-18-11-16(12-20-13-18)5-4-15-6-8-19-9-7-15/h4-9,11-13,17H,2-3,10,14H2,1H3/b5-4+/t17-/m0/s1
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 0.120n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097607
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-p-tolyl-...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(C)cc1
Show InChI InChI=1S/C18H22N2O/c1-14-5-7-15(8-6-14)16-10-18(12-19-11-16)21-13-17-4-3-9-20(17)2/h5-8,10-12,17H,3-4,9,13H2,1-2H3/t17-/m0/s1
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 0.130n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097614
PNG
(3-Benzofuran-2-yl-5-((S)-1-methyl-pyrrolidin-2-ylm...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cc2ccccc2o1
Show InChI InChI=1S/C19H20N2O2/c1-21-8-4-6-16(21)13-22-17-9-15(11-20-12-17)19-10-14-5-2-3-7-18(14)23-19/h2-3,5,7,9-12,16H,4,6,8,13H2,1H3/t16-/m0/s1
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 0.150n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonistic activity against neuronal nicotinic acetylcholine receptor (alpha3-betaX subunit) in IMR 32 cell line using 100 uM of (-)-nicotine as ag...

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097600
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-(4-trifl...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C18H19F3N2O/c1-23-8-2-3-16(23)12-24-17-9-14(10-22-11-17)13-4-6-15(7-5-13)18(19,20)21/h4-7,9-11,16H,2-3,8,12H2,1H3/t16-/m0/s1
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 0.150n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50049756
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-pyridine |...)
Show SMILES CN1CCC[C@H]1COc1cccnc1
Show InChI InChI=1S/C11H16N2O/c1-13-7-3-4-10(13)9-14-11-5-2-6-12-8-11/h2,5-6,8,10H,3-4,7,9H2,1H3/t10-/m0/s1
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 0.150n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097613
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-phenylet...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)C#Cc1ccccc1
Show InChI InChI=1S/C19H20N2O/c1-21-11-5-8-18(21)15-22-19-12-17(13-20-14-19)10-9-16-6-3-2-4-7-16/h2-4,6-7,12-14,18H,5,8,11,15H2,1H3/t18-/m0/s1
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 0.160n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097616
PNG
(3-(2,4-Dichloro-phenyl)-5-((S)-1-methyl-pyrrolidin...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H18Cl2N2O/c1-21-6-2-3-14(21)11-22-15-7-12(9-20-10-15)16-5-4-13(18)8-17(16)19/h4-5,7-10,14H,2-3,6,11H2,1H3/t14-/m0/s1
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 0.160n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097603
PNG
(3-Furan-2-yl-5-((S)-1-methyl-pyrrolidin-2-ylmethox...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccco1
Show InChI InChI=1S/C15H18N2O2/c1-17-6-2-4-13(17)11-19-14-8-12(9-16-10-14)15-5-3-7-18-15/h3,5,7-10,13H,2,4,6,11H2,1H3/t13-/m0/s1
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 0.190n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097602
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-phenethy...)
Show SMILES CN1CCC[C@H]1COc1cncc(CCc2ccccc2)c1
Show InChI InChI=1S/C19H24N2O/c1-21-11-5-8-18(21)15-22-19-12-17(13-20-14-19)10-9-16-6-3-2-4-7-16/h2-4,6-7,12-14,18H,5,8-11,15H2,1H3/t18-/m0/s1
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 0.220n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097601
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-((E)-sty...)
Show SMILES CN1CCC[C@H]1COc1cncc(\C=C\c2ccccc2)c1
Show InChI InChI=1S/C19H22N2O/c1-21-11-5-8-18(21)15-22-19-12-17(13-20-14-19)10-9-16-6-3-2-4-7-16/h2-4,6-7,9-10,12-14,18H,5,8,11,15H2,1H3/b10-9+/t18-/m0/s1
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 0.240n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097612
PNG
(5-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-[3,3']bipy...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cccnc1
Show InChI InChI=1S/C16H19N3O/c1-19-7-3-5-15(19)12-20-16-8-14(10-18-11-16)13-4-2-6-17-9-13/h2,4,6,8-11,15H,3,5,7,12H2,1H3/t15-/m0/s1
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 0.270n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097592
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-thiophen...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cccs1
Show InChI InChI=1S/C15H18N2OS/c1-17-6-2-4-13(17)11-18-14-8-12(9-16-10-14)15-5-3-7-19-15/h3,5,7-10,13H,2,4,6,11H2,1H3/t13-/m0/s1
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 0.310n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097615
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-p-tolyle...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)C#Cc1ccc(C)cc1
Show InChI InChI=1S/C20H22N2O/c1-16-5-7-17(8-6-16)9-10-18-12-20(14-21-13-18)23-15-19-4-3-11-22(19)2/h5-8,12-14,19H,3-4,11,15H2,1-2H3/t19-/m0/s1
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 0.310n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097598
PNG
(1-Methyl-2-[5-((S)-1-methyl-pyrrolidin-2-ylmethoxy...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cc2ccccc2n1C
Show InChI InChI=1S/C20H23N3O/c1-22-9-5-7-17(22)14-24-18-10-16(12-21-13-18)20-11-15-6-3-4-8-19(15)23(20)2/h3-4,6,8,10-13,17H,5,7,9,14H2,1-2H3/t17-/m0/s1
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 0.320n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097604
PNG
(3-(4-Methoxy-phenyl)-5-((S)-1-methyl-pyrrolidin-2-...)
Show SMILES COc1ccc(cc1)-c1cncc(OC[C@@H]2CCCN2C)c1
Show InChI InChI=1S/C18H22N2O2/c1-20-9-3-4-16(20)13-22-18-10-15(11-19-12-18)14-5-7-17(21-2)8-6-14/h5-8,10-12,16H,3-4,9,13H2,1-2H3/t16-/m0/s1
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 0.320n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097593
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-naphthal...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccc2ccccc2c1
Show InChI InChI=1S/C21H22N2O/c1-23-10-4-7-20(23)15-24-21-12-19(13-22-14-21)18-9-8-16-5-2-3-6-17(16)11-18/h2-3,5-6,8-9,11-14,20H,4,7,10,15H2,1H3/t20-/m0/s1
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 0.330n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097611
PNG
(5-[5-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-pyridin...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cncnc1
Show InChI InChI=1S/C15H18N4O/c1-19-4-2-3-14(19)10-20-15-5-12(6-16-9-15)13-7-17-11-18-8-13/h5-9,11,14H,2-4,10H2,1H3/t14-/m0/s1
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 0.370n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097594
PNG
(3-[5-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-pyridin...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C20H21N3O/c1-23-8-4-6-18(23)14-24-19-10-17(11-21-13-19)16-9-15-5-2-3-7-20(15)22-12-16/h2-3,5,7,9-13,18H,4,6,8,14H2,1H3/t18-/m0/s1
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 0.390n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097609
PNG
(3-[5-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-pyridin...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cccc(N)c1
Show InChI InChI=1S/C17H21N3O/c1-20-7-3-6-16(20)12-21-17-9-14(10-19-11-17)13-4-2-5-15(18)8-13/h2,4-5,8-11,16H,3,6-7,12,18H2,1H3/t16-/m0/s1
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 0.430n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097599
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-(3-nitro...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C17H19N3O3/c1-19-7-3-6-16(19)12-23-17-9-14(10-18-11-17)13-4-2-5-15(8-13)20(21)22/h2,4-5,8-11,16H,3,6-7,12H2,1H3/t16-/m0/s1
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 0.465n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097595
PNG
(2-[5-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-pyridin...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccccc1C=O
Show InChI InChI=1S/C18H20N2O2/c1-20-8-4-6-16(20)13-22-17-9-15(10-19-11-17)18-7-3-2-5-14(18)12-21/h2-3,5,7,9-12,16H,4,6,8,13H2,1H3/t16-/m0/s1
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 0.560n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097610
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-o-tolyl-...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1ccccc1C
Show InChI InChI=1S/C18H22N2O/c1-14-6-3-4-8-18(14)15-10-17(12-19-11-15)21-13-16-7-5-9-20(16)2/h3-4,6,8,10-12,16H,5,7,9,13H2,1-2H3/t16-/m0/s1
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 1.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097591
PNG
(3-(3,5-Bis-trifluoromethyl-phenyl)-5-((S)-1-methyl...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H18F6N2O/c1-27-4-2-3-16(27)11-28-17-7-13(9-26-10-17)12-5-14(18(20,21)22)8-15(6-12)19(23,24)25/h5-10,16H,2-4,11H2,1H3/t16-/m0/s1
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 2.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))		BDBM50097605
PNG
(3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-naphthal...)
Show SMILES CN1CCC[C@H]1COc1cncc(c1)-c1cccc2ccccc12
Show InChI InChI=1S/C21H22N2O/c1-23-11-5-8-18(23)15-24-19-12-17(13-22-14-19)21-10-4-7-16-6-2-3-9-20(16)21/h2-4,6-7,9-10,12-14,18H,5,8,11,15H2,1H3/t18-/m0/s1
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 4.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]-(-)-cytisine binding to whole rat brain membranes at Nicotinic acetylcholine receptor alpha4-beta2

Bioorg Med Chem Lett 11: 631-3 (2001)


BindingDB Entry DOI: 10.7270/Q2WM1CPS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%