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Neuronal acetylcholine receptor; alpha4/beta4 Inhibitors (IC50, Ki)

Structure
Compound Name
Standard Type
Standard Values (in nM)
NicotineKi23.0 [1], 40.0 [2], 70.0 [3], 129.0 [4]
BupropionIC5015.0 [1], 12000.0 [2], 15000.0 [3]
RadafaxineIC5030000.0 [1], 41000.0 [2]
(2S,3S)-2-(3-Fluorophenyl)-3,5,5-trimethylmorpholin-2-olIC5055000.0 [1], 100000.0 [2]
(2S,3S)-2-(3-Bromophenyl)-3,5,5-trimethylmorpholin-2-olIC5011000.0 [1], 30000.0 [2]
(2S,3S)-2-(3-Chlorophenyl)-3-ethyl-5,5-dimethylmorpholin-2-olIC5015000.0 [1], 16000.0 [2]
(2S,3S)-2-(3-Chlorophenyl)-5,5-dimethyl-3-propyl-morpholin-2-olIC508000.0 [1], 18000.0 [2]
(2S,3S)-2-(3-Chlorophenyl)-3,4,5,5-tetramethylmorpholin-2-olIC5023000.0 [1], 43000.0 [2]
(R,R)-Hydroxy BupropionIC5012000.0 [1], 30000.0 [2]
7,8,9,10-Tetrahydro-6,10-methano-6H-pyrazino(2,3-h)(3)benzazepineKi28.0 [1]
VareniclineKi110.0 [1]
EpibatidineKi0.07 [1]
alpha-MethyltryptamineKi10000.0 [1]
Sazetidine AKi52.0 [1]
N,N-Diallyl-5-methoxytryptamineKi10000.0 [1]
4-(6-Fluoro-5,5-dioxido-3-dibenzothienyl)-1,4-diazabicyclo(3.2.2)nonaneKi1000.0 [1]
3-(4-Chlorophenyl)-5-[(1R,2S,3S,5S)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octan-2-yl]-1,2-oxazoleIC5057000.0 [1]
2-(Tert-butyl(methyl)amino)-1-(3-chlorophenyl)propan-1-oneIC5016.0 [1]
2-(Tert-butylamino)-1-(3-fluorophenyl)propan-1-oneIC5052.0 [1]
2-(Tert-butylamino)-1-(3-chlorophenyl)butan-1-oneIC506.2 [1]
2-(Tert-butylamino)-1-(3-chlorophenyl)pentan-1-oneIC504.9 [1]
1-(3-Bromophenyl)-2-(tert-butylamino)propan-1-oneIC5013.0 [1]
2-(Tert-butylamino)-1-(4-chlorophenyl)propan-1-oneIC5018.0 [1]
1-(3-Chlorophenyl)-2-(piperidin-1-yl)propan-1-oneIC5083.0 [1]
1-(3-Chlorophenyl)-2-(dimethylamino)propan-1-oneIC5033.0 [1]
3-(Tert-butylamino)-1-(3-chlorophenyl)-2-methylpropan-1-oneIC5036.0 [1]
1-(4-Bromophenyl)-2-(tert-butylamino)propan-1-oneIC5013.0 [1]
2-(Tert-butylamino)-1-(3-chloro-4-methylphenyl)propan-1-oneIC504.8 [1]
2-(Tert-butylamino)-1-(3,5-dichlorophenyl)propan-1-oneIC5022.0 [1]
2-(Tert-butylamino)-1-(3,4-dichlorophenyl)butan-1-oneIC503.3 [1]
2-(N-Tert-Butylamino)-1-(2'-thienyl)-1-propanoneIC50100.0 [1]
2-(Tert-butylamino)-1-m-tolylpropan-1-oneIC5017.0 [1]
2-(Tert-butylamino)-1-(3,4-difluorophenyl)propan-1-oneIC5040.0 [1]
1-(4-Bromo-3-methylphenyl)-2-(tert-butylamino)propan-1-oneIC5018.0 [1]
1-(3-Chlorophenyl)-2-(cyclopentylamino)propan-1-oneIC50100.0 [1]
2-(Tert-butylamino)-1-(3,4-dichlorophenyl)pentan-1-oneIC504.2 [1]
2-(Tert-butylamino)-1-(3,4-dichlorophenyl)propan-1-oneIC5012.0 [1]
2-(Tert-butylamino)-1-p-tolylpropan-1-oneIC5016.0 [1]
3-Ethyl-5-[(1R,2S,3S,5S)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octan-2-yl]-1,2-oxazoleIC509900.0 [1]
Methyl (1R,2S,3R,5S)-3-(3-fluoro-4-methylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylateIC5025000.0 [1]
5-[(1R,2S,3S,5S)-3-(4-Chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]-3-(4-methoxyphenyl)-1,2-oxazoleIC50100000.0 [1]
6-(6-Chloropyridin-3-yl)-8-azabicyclo[3.2.1]octan-3-olKi38.0 [1]
(3S)-3-[[(2S)-1-[(2S)-4-Amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[(2-aminoacetyl)amino]-3-sulfanylpropanoyl]amino]-3-sulfanylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-3-sulfanylpropanoyl]amino]-3-phenylpropanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxo-4-[[(2R)-1-oxo-3-sulfanylpropan-2-yl]amino]butanoic acidIC500.75 [1]
(2S)-1-[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[(2-Aminoacetyl)amino]-3-sulfanylpropanoyl]amino]-3-sulfanylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]-N-[(2R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[2-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]pyrrolidine-2-carboxamideIC501.5 [1]
3-(Dimethylamino)butyl 4-chlorophenyl(methyl)carbamateKi3981.07 [1]
3-(Dimethylamino)butyl 4-cyanophenyl(methyl)carbamateKi10000.0 [1]
3-(Dimethylamino)butyl benzyl(methyl)carbamateKi398.11 [1]
3-(Dimethylamino)butyl carbamateKi1995.26 [1]
3-(Dimethylamino)butyl ethylcarbamateKi794.33 [1]
3-(Dimethylamino)butyl propylcarbamateKi1584.89 [1]
3-(Dimethylamino)butyl 2-hydroxyethylcarbamateKi7943.28 [1]
5-(Dimethylamino)-N,N-dimethylhexanamideKi79432.82 [1]
5-(Dimethylamino)-N-methylhex-2-enamideKi5011.87 [1]
5-(Dimethylamino)-N,N-dimethylhex-2-enamideKi2511.89 [1]
O-3-(Dimethylamino)butyl dimethylcarbamothioateKi6309.57 [1]
3-(Dimethylamino)butyl 3-phenylpropylcarbamateKi1584.89 [1]
S-3-(Dimethylamino)butyl dimethylcarbamothioateKi19952.62 [1]
3-(3-(Dimethylamino)butyl)-1,1-dimethylureaKi100000.0 [1]
1-(3-(Dimethylamino)butyl)-3-phenylureaKi316227.77 [1]
3-(Dimethylamino)-4-hydroxybutyl dimethylcarbamateKi19952.62 [1]
3-Cyclopropyl-3-(dimethylamino)propyl dimethylcarbamateKi3981.07 [1]
3-(Dimethylamino)-3-(thiophen-3-yl)propyl dimethylcarbamateKi3162.28 [1]
3-(Dimethylamino)-3-phenylpropyl dimethylcarbamateKi6309.57 [1]
3-(Dimethylamino)butyl 2-hydroxyethyl(methyl)carbamateKi3981.07 [1]
3-(Dimethylamino)butyl methyl(phenyl)carbamateKi3162.28 [1]
2-(Tert-butylamino)-1-(3-methoxyphenyl)propan-1-oneIC5023.0 [1]
2-(Tert-butylamino)-1-(3-nitrophenyl)propan-1-oneIC5074.0 [1]
2-(Cyclopentylamino)-1-(3-fluorophenyl)propan-1-oneIC50100.0 [1]
1-(3-Bromophenyl)-2-(cyclopentylamino)propan-1-oneIC5027.0 [1]
2-(Cyclopentylamino)-1-(3-methylphenyl)propan-1-oneIC5023.0 [1]
2-(Cyclopentylamino)-1-(3-methoxyphenyl)propan-1-oneIC5046.0 [1]
2-(Cyclopentylamino)-1-(3-nitrophenyl)propan-1-oneIC5060.0 [1]
1-(3-Fluorophenyl)-2-piperidin-1-ylpropan-1-oneIC50100.0 [1]
1-(3-Bromophenyl)-2-piperidin-1-ylpropan-1-oneIC5064.0 [1]
1-(3-Methylphenyl)-2-piperidin-1-ylpropan-1-oneIC50100.0 [1]
1-(3-Methoxyphenyl)-2-piperidin-1-ylpropan-1-oneIC50100.0 [1]
1-(3-Nitrophenyl)-2-piperidin-1-ylpropan-1-oneIC50100.0 [1]
(2S,3S)-2-Phenyl-3,5,5-trimethylmorpholin-2-olIC5092000.0 [1]
(2S,3S)-2-(m-Tolyl)-3,5,5-trimethylmorpholin-2-olIC5064000.0 [1]
(2S,3S)-2-(3-Methoxyphenyl)-3,5,5-trimethylmorpholin-2-olIC50100000.0 [1]
(2S,3S)-2-(3-Nitrophenyl)-3,5,5-trimethylmorpholin-2-olIC5080000.0 [1]
(2S,3S)-2-(4-Fluorophenyl)-3,5,5-trimethylmorpholin-2-olIC50100000.0 [1]
(2S,3S)-2-(4-Chlorophenyl)-3,5,5-trimethylmorpholin-2-olIC5033000.0 [1]
(2S,3S)-3,5,5-Trimethyl-2-(4-methylphenyl)morpholin-2-olIC5062000.0 [1]
(2S,3S)-2-(4-Methoxyphenyl)-3,5,5-trimethylmorpholin-2-olIC5072000.0 [1]
(2S,3S)-2-Biphenyl-4-yl-3,5,5-trimethylmorpholin-2-olIC508100.0 [1]
(2S,3S)-2-(3,4-Difluorophenyl)-3,5,5-trimethylmorpholin-2-olIC50100000.0 [1]
(2S,3S)-2-(3,5-Difluorophenyl)-3,5,5-trimethylmorpholin-2-olIC5062000.0 [1]
(2S,3S)-2-(4-Chlorophenyl)-3,4,5,5-tetramethylmorpholin-2-olIC5091000.0 [1]
3,5,5-Trimethyl-2-(pyridin-3-yl)morpholin-2-olIC50100000.0 [1]
3,5,5-Trimethyl-2-(pyridin-2-yl)morpholin-2-olIC50100000.0 [1]
2-(3,4-Dichlorophenyl)-3,5,5-trimethylmorpholin-2-olIC5014000.0 [1]
CID 49799634IC5018000.0 [1]
(2S,3S)-3,5,5-Trimethyl-2-(3-naphthalen-1-ylphenyl)morpholin-2-olIC5013000.0 [1]
(2S,3S)-3,5,5-Trimethyl-2-(3-naphthalen-2-ylphenyl)morpholin-2-olIC5011000.0 [1]
2-[(1R,2S,3S,5S)-3-(4-Chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]-5,6-dimethyl-1H-benzimidazoleIC504300.0 [1]
Methyl (1R,2S,3S,5S)-3-(4-chloro-3-methylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylateIC5012000.0 [1]
5-[(1R,2S,3S,5S)-3-(4-Chloro-3-methylphenyl)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]-3-methyl-1,2-oxazoleIC505800.0 [1]
5-[(1R,2S,3S,5S)-3-(4-Chloro-3-methylphenyl)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]-3-phenyl-1,2-oxazoleIC504600.0 [1]
Methyl (1R,2S,3R,5S)-3-(4-chloro-3-methylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylateIC5015000.0 [1]



References

This online tool may be cited as follows

MLA

"Quest Database™ Neuronal acetylcholine receptor; alpha4/beta4 Inhibitors (IC50, Ki)." AAT Bioquest, Inc.10 May2024https://www.aatbio.com/data-sets/neuronal-acetylcholine-receptor-alpha4-beta4-inhibitors-ic50-ki.

APA

AAT Bioquest, Inc. (2024May 10). Quest Database™ Neuronal acetylcholine receptor; alpha4/beta4 Inhibitors (IC50, Ki). AAT Bioquest. https://www.aatbio.com/data-sets/neuronal-acetylcholine-receptor-alpha4-beta4-inhibitors-ic50-ki.
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