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Cytochrome P450 2A6 Inhibitors (IC50, Ki)

Structure
▲
▼
Compound Name
▲
▼
Standard Type
▲
▼
Standard Values (in nM)
▲
▼
(5-Pyrid-3-ylthien-2-YL)methylamineIC50160.0 [1], 170.0 [2], 7440.0 [3]
(5-Pyrid-3-ylthien-2-YL)methylamineKi20.0 [1], 80.0 [2]
(5-(Pyridin-3-YL)furan-2-YL)methanamineIC50200.0 [1], 270.0 [2], 16900.0 [3]
(5-(Pyridin-3-YL)furan-2-YL)methanamineKi40.0 [1], 100.0 [2]
3-(1H-Imidazol-4-yl)pyridineIC501500.0 [1], 1510.0 [2], 800000.0 [3]
3-(1H-Imidazol-4-yl)pyridineKi250.0 [1], 800.0 [2]
3-(3-Methylthiophen-2-yl)pyridineIC50200.0 [1], 620.0 [2], 622.0 [3]
3-(3-Methylthiophen-2-yl)pyridineKi100.0 [1], 300.0 [2]
Pyridine, 3-(1-methyl-1H-imidazol-4-yl)-IC50748.0 [1], 750.0 [2]
Pyridine, 3-(1-methyl-1H-imidazol-4-yl)-Ki130.0 [1], 400.0 [2]
3-(4-Methylthiophen-3-yl)pyridineIC501500.0 [1], 1850.0 [2]
3-(4-Methylthiophen-3-yl)pyridineKi250.0 [1], 900.0 [2]
3-(2-Methyl-1H-imidazol-1-yl)pyridineIC501500.0 [1]
3-(2-Methyl-1H-imidazol-1-yl)pyridineKi250.0 [1], 700.0 [2]
3-(3-Thienyl)pyridineIC501370.0 [1], 1400.0 [2]
3-(3-Thienyl)pyridineKi220.0 [1], 700.0 [2]
NicotineIC50579428.7 [1]
NicotineKi4400.0 [1], 130000.0 [2]
3,3'-BipyridineIC506600.0 [1]
3,3'-BipyridineKi1100.0 [1]
Benzo[b]thiophene-2-carboxaldehydeIC50800.0 [1], 3200.0 [2]
Benzo[b]thiophene-2-carboxaldehydeKi130.0 [1]
Methyl[3-(pyridin-3-yl)prop-2-yn-1-yl]amineIC505360.0 [1]
Methyl[3-(pyridin-3-yl)prop-2-yn-1-yl]amineKi890.0 [1], 2700.0 [2]
Dimethyl[3-(pyridin-3-yl)prop-2-yn-1-yl]amineIC50136000.0 [1]
Dimethyl[3-(pyridin-3-yl)prop-2-yn-1-yl]amineKi22700.0 [1], 67500.0 [2]
2-Fluoro-5-(3-methylthiophen-2-yl)pyridineIC501290.0 [1]
2-Fluoro-5-(3-methylthiophen-2-yl)pyridineKi210.0 [1], 600.0 [2]
N,N-Dimethyl(5-(pyridin-3-yl)furan-2-yl)methanamineIC5028300.0 [1]
N,N-Dimethyl(5-(pyridin-3-yl)furan-2-yl)methanamineKi14200.0 [1], 47200.0 [2]
N-Methyl(5-(pyridin-3-yl)furan-2-yl)methanamineIC501650.0 [1]
N-Methyl(5-(pyridin-3-yl)furan-2-yl)methanamineKi280.0 [1], 800.0 [2]
3-(Pyridin-3-yl)prop-2-yn-1-amineIC50514.0 [1]
3-(Pyridin-3-yl)prop-2-yn-1-amineKi90.0 [1], 300.0 [2]
Dimethyl({[5-(pyridin-3-yl)thiophen-2-yl]methyl})amineIC50133000.0 [1]
Dimethyl({[5-(pyridin-3-yl)thiophen-2-yl]methyl})amineKi22200.0 [1], 66500.0 [2]
N-Methyl-(5-pyrid-3-ylthien-2-yl)methylamineIC501100.0 [1]
N-Methyl-(5-pyrid-3-ylthien-2-yl)methylamineKi180.0 [1], 600.0 [2]
1-Benzofuran-5-carbaldehydeIC5050.0 [1], 400.0 [2]
1-Benzofuran-5-carbaldehydeKi5500.0 [1]
3-(2-Thienyl)pyridineIC507800.0 [1]
3-(2-Thienyl)pyridineKi1200.0 [1]
5-(Pyridin-3-yl)thiophene-2-carbaldehydeIC504770.0 [1], 4800.0 [2]
5-(Pyridin-3-yl)thiophene-2-carbaldehydeKi790.0 [1]
3-(1-Benzyl-1H-imidazol-4-yl)pyridineIC501390.0 [1], 1400.0 [2]
3-(1-Benzyl-1H-imidazol-4-yl)pyridineKi230.0 [1]
Pyridine, 2-fluoro-5-(3-thienyl)-IC505800.0 [1], 5840.0 [2]
Pyridine, 2-fluoro-5-(3-thienyl)-Ki970.0 [1]
Pyridine, 2-fluoro-5-(4-methyl-3-thienyl)-IC501300.0 [1], 15800.0 [2]
Pyridine, 2-fluoro-5-(4-methyl-3-thienyl)-Ki2600.0 [1]
3-(1-Ethyl-1H-imidazol-4-yl)pyridineIC503100.0 [1], 3140.0 [2]
3-(1-Ethyl-1H-imidazol-4-yl)pyridineKi520.0 [1]
1-(5-(Pyridin-3-yl)thiophen-2-yl)ethan-1-oneIC508600.0 [1], 8610.0 [2]
1-(5-(Pyridin-3-yl)thiophen-2-yl)ethan-1-oneKi1400.0 [1]
1-Benzofuran-5-carbonitrileIC50600.0 [1], 1600.0 [2]
1-Benzofuran-5-carbonitrileKi200.0 [1]
5-Bromobenzo[b]thiophene-3-carbaldehydeIC50500.0 [1], 5000.0 [2]
5-Bromobenzo[b]thiophene-3-carbaldehydeKi1500.0 [1]
NaphthaleneIC5025000.0 [1], 25003.45 [2]
CotinineIC50400000.0 [1], 35000000.0 [2]
PhenanthreneIC5097000.0 [1], 97051.0 [2]
1-NaphtholIC50130000.0 [1], 130016.96 [2]
2-NaphtholIC50139958.73 [1], 140000.0 [2]
DolutegravirIC50100000.0 [1]
SaxagliptinIC5050000.0 [1]
1,4-DichlorobenzeneIC5016982.44 [1], 17000.0 [2]
2-MethylnaphthaleneIC502398.83 [1], 2400.0 [2]
1-MethylnaphthaleneIC5033962.53 [1], 34000.0 [2]
4-ChlorobiphenylIC50149968.48 [1], 150000.0 [2]
2-MethylquinolineIC50190000.0 [1], 190107.83 [2]
1-TetraloneIC5051999.6 [1], 52000.0 [2]
2-ChlorobiphenylIC5035974.93 [1], 36000.0 [2]
(1S,2R)-2-Phenylcyclopropan-1-amine;(1R,2S)-2-phenylcyclopropan-1-amineIC50970.0 [1]
(1S,2R)-2-Phenylcyclopropan-1-amine;(1R,2S)-2-phenylcyclopropan-1-amineKi130.0 [1]
1-ChloronaphthaleneIC5017988.71 [1], 18000.0 [2]
2-ChloronaphthaleneIC505395.11 [1], 5400.0 [2]
2,6-DimethylnaphthaleneIC5010000.0 [1]
1,4-DibromobenzeneIC5059000.0 [1], 59020.11 [2]
ParadolIC5030000.0 [1]
1,2-DimethylnaphthaleneIC5026000.0 [1], 26001.6 [2]
2-MethoxynaphthaleneIC5061944.11 [1], 62000.0 [2]
2-TetraloneIC5020989.4 [1], 21000.0 [2]
3-MethylquinolineIC50199986.19 [1], 200000.0 [2]
2-EthylnaphthaleneIC5011994.99 [1], 12000.0 [2]
(1S,3S,5S)-2-[(2S)-2-Amino-2-(3,5-dihydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrileIC50200000.0 [1]
NicotyrineIC502200.0 [1]
NicotyrineKi7500.0 [1]
2,3'-BipyridineIC5046100.0 [1]
2,3'-BipyridineKi7700.0 [1]
3-(2H-Tetrazol-5-yl)pyridineIC50389000.0 [1]
3-(2H-Tetrazol-5-yl)pyridineKi64800.0 [1]
5-BromoindoleIC506400.0 [1], 7400.0 [2]
1,6-DimethylnaphthaleneIC50130000.0 [1], 130016.96 [2]
1H-Indole-2-carbaldehydeIC501800.0 [1], 11000.0 [2]
2-BromonaphthaleneIC50549.54 [1], 550.0 [2]
2,6-DimethylquinolineIC50279898.13 [1], 280000.0 [2]
3-MethylisoquinolineIC5025000.0 [1], 25003.45 [2]
1-MethylisoquinolineIC5059979.11 [1], 60000.0 [2]
1,5-DimethylnaphthaleneIC5030974.19 [1], 31000.0 [2]
2,7-DimethylnaphthaleneIC501698.24 [1], 1700.0 [2]
Items per page: 1 - 10 of 100
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References

This online tool may be cited as follows

MLA

"Quest Database™ Cytochrome P450 2A6 Inhibitors (IC50, Ki)." AAT Bioquest, Inc., 22 Feb. 2025, https://www.aatbio.com/data-sets/cytochrome-p450-2a6-inhibitors-ic50-ki.

APA

AAT Bioquest, Inc. (2025, February 22). Quest Database™ Cytochrome P450 2A6 Inhibitors (IC50, Ki). AAT Bioquest. https://www.aatbio.com/data-sets/cytochrome-p450-2a6-inhibitors-ic50-ki.
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