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Literature summary for 1.11.2.2 extracted from

  • Shaw, S.A.; Vokits, B.P.; Dilger, A.K.; Viet, A.; Clark, C.G.; Abell, L.M.; Locke, G.A.; Duke, G.; Kopcho, L.M.; Dongre, A.; Gao, J.; Krishnakumar, A.; Jusuf, S.; Khan, J.; Spronk, S.A.; Basso, M.D.; Zhao, L.; Cantor, G.H.; Onorato, J.M.; Wexler, R.R.; Duclos, F.; Kick, E.K.
    Discovery and structure activity relationships of 7-benzyl triazolopyridines as stable, selective, and reversible inhibitors of myeloperoxidase (2020), Bioorg. Med. Chem., 28, 115723 .
    View publication on PubMed

Crystallization (Commentary)

Crystallization (Comment) Organism
hanging drop vapor diffusion method, using 100 mM HEPES (pH 7.5), 150 mM NaCl, 20-25% (w/v) PEG3350 Homo sapiens

Inhibitors

Inhibitors Comment Organism Structure
(R)-7-(1,2-diphenylethyl)-1-methyl-1H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(1,4-diphenylbutyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(1-phenyl-3-((2-(trifluoromethyl)benzyl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(1-phenyl-3-((4-phenylbicyclo[2.2.2]octan-1-yl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine trifluoroacetate salt
-
Homo sapiens
(R)-7-(1-phenyl-3-((pyridin-2-ylmethyl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(1-phenyl-4-(4-phenylpiperidin-1-yl)butyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(3-((2-fluoroethyl)(4-phenylbicyclo[2.2.2]octan-1-yl)amino)-1-phenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(3-(benzylamino)-1-phenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(3-(benzyloxy)-1-phenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
(R)-7-(3-(methyl(4-phenylbicyclo[2.2.2]octan-1-yl)amino)-1-phenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
2-[6-(5-chloro-2-methoxyphenyl)-4-oxo-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl]acetamide i.e. PF-06282999, irreversible inhibitor Homo sapiens
2-[[3,5-bis(trifluoromethyl)benzyl]amino]-N,4-dihydroxypyrimidine-5-carboxamide
-
Homo sapiens
3-((5-amino-3H-[1,2,3]triazolo[4,5-b] pyridin-7-yl)methyl)benzonitrile
-
Homo sapiens
3-([(2R)-oxolan-2-yl]methyl)-2-sulfanylidene-1,2,3,7-tetrahydro-6H-purin-6-one i.e. TX4, irreversible inhibitor Homo sapiens
7-((R)-1-phenyl-3-(((1R,3R)-3-phenylcyclopentyl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-((R)-1-phenyl-3-(((1R,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-((R)-1-phenyl-3-(((1S,3S)-3-phenyl-2,3-dihydro-1H-inden-1-yl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-((R)-1-phenyl-3-(((3R,6S)-6-phenyltetrahydro-2H-pyran-3-yl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-((R)-1-phenyl-3-((trans-4-phenylcyclohexyl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-((R)-3-(((S)-2,3-dihydro-1H-inden-1-yl)amino)-1-phenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(1,4-diphenylpropyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(1-phenyl-3-((1-phenyl-2-oxabicyclo[2.2.2]octan-4-yl)amino)propyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(2-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
-
Homo sapiens
7-(2-fluorobenzyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(3-(trifluoromethyl)benzyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(3-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
-
Homo sapiens
7-(3-methoxycarbonylbenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
-
Homo sapiens
7-(3-phenylbenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
-
Homo sapiens
7-(4-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
-
Homo sapiens
7-(benzyloxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-(naphthalen-2-ylmethyl)-3H-[1,2,3] triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
7-benzyl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
-
Homo sapiens
tryptamine
-
Homo sapiens

Natural Substrates/ Products (Substrates)

Natural Substrates Organism Comment (Nat. Sub.) Natural Products Comment (Nat. Pro.) Rev. Reac.
Cl- + H2O2 + H+ Homo sapiens
-
HClO + H2O
-
?

Organism

Organism UniProt Comment Textmining
Homo sapiens P05164
-
-

Purification (Commentary)

Purification (Comment) Organism
Superdex 75 gel filtration Homo sapiens

Substrates and Products (Substrate)

Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
Amplex Red + H2O2 + H+
-
Homo sapiens resorufin + H2O
-
?
Cl- + H2O2 + H+
-
Homo sapiens HClO + H2O
-
?

Synonyms

Synonyms Comment Organism
MPO
-
Homo sapiens

Cofactor

Cofactor Comment Organism Structure
heme
-
Homo sapiens

IC50 Value

IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
0.000017
-
at pH 7.4 and 25°C Homo sapiens 7-(3-methoxycarbonylbenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
0.000026
-
at pH 7.4 and 25°C Homo sapiens 3-((5-amino-3H-[1,2,3]triazolo[4,5-b] pyridin-7-yl)methyl)benzonitrile
0.000032
-
at pH 7.4 and 25°C Homo sapiens 7-(3-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
0.000036
-
at pH 7.4 and 25°C Homo sapiens 7-(benzyloxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
0.000043
-
at pH 7.4 and 25°C Homo sapiens 7-benzyl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
0.000046
-
at pH 7.4 and 25°C Homo sapiens 7-(2-fluorobenzyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
0.000077
-
at pH 7.4 and 25°C Homo sapiens 7-(3-phenylbenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
0.000188
-
at pH 7.4 and 25°C Homo sapiens 7-(naphthalen-2-ylmethyl)-3H-[1,2,3] triazolo[4,5-b]pyridin-5-amine
0.00099
-
at pH 7.4 and 25°C Homo sapiens 7-(2-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine
0.001426
-
at pH 7.4 and 25°C Homo sapiens 7-(3-(trifluoromethyl)benzyl)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
0.0093
-
at pH 7.4 and 25°C Homo sapiens 7-(4-chlorobenzyl)-3H-[1,2,3]triazolo [4,5-b]pyridin-5-amine