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Literature summary for 3.1.1.8 extracted from

  • Nakayama, K.; Schwans, J.P.; Sorin, E.J.; Tran, T.; Gonzalez, J.; Arteaga, E.; McCoy, S.; Alvarado, W.
    Synthesis, biochemical evaluation, and molecular modeling studies of aryl and arylalkyl di-n-butyl phosphates, effective butyrylcholinesterase inhibitors (2017), Bioorg. Med. Chem., 25, 3171-3181 .
    View publication on PubMed

Inhibitors

Inhibitors Comment Organism Structure
(dibutyl phosphoric) hypochlorous anhydride
-
Equus caballus
benzyl di-n-butyl phosphate
-
Equus caballus
butyl ethyl phenyl phosphate
-
Equus caballus
di-n-butyl 2-chlorophenyl phosphate irreversible inhibition Equus caballus
di-n-butyl 2-methylbenzyl phosphate
-
Equus caballus
di-n-butyl 2-methylphenyl phosphate reversible inhibition Equus caballus
di-n-butyl 2-naphthyl phosphate
-
Equus caballus
di-n-butyl 2-phenylethyl phosphate
-
Equus caballus
di-n-butyl 3,4,5-trimethylphenyl phosphate
-
Equus caballus
di-n-butyl 3,4-dimethylphenyl phosphate
-
Equus caballus
di-n-butyl 3,5-dimethylphenyl phosphate
-
Equus caballus
di-n-butyl 3-methylbenzyl phosphate
-
Equus caballus
di-n-butyl 3-methylphenyl phosphate reversible inhibition Equus caballus
di-n-butyl 4-methylbenzyl phosphate
-
Equus caballus
di-n-butyl 4-methylphenyl phosphate reversible inhibition Equus caballus
di-n-butyl naphthalen-1-yl phosphate
-
Equus caballus
di-n-butyl phenyl phosphate
-
Equus caballus
di-n-pentyl phenyl phosphate
-
Equus caballus
dicyclohexyl phenyl phosphate
-
Equus caballus
diethyl 2-naphthyl phosphate
-
Equus caballus
diethyl 3,5-dimethylphenyl phosphate
-
Equus caballus
diethyl phenyl phosphate
-
Equus caballus
dimethyl phenyl phosphate
-
Equus caballus
additional information synthesis, biochemical evaluation, and molecular modeling studies of aryl and arylalkyl di-n-butyl phosphates, effective butyrylcholinesterase inhibitors, overview. Analysis of enzyme binding structure, structure-function analysis, modeling Equus caballus
phenyl dipropyl phosphate
-
Equus caballus

Organism

Organism UniProt Comment Textmining
Equus caballus P81908
-
-

Source Tissue

Source Tissue Comment Organism Textmining
commercial preparation
-
Equus caballus
-
serum
-
Equus caballus
-

Substrates and Products (Substrate)

Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
butyrylthiocholine + H2O
-
Equus caballus thiocholine + butyrate
-
?

Synonyms

Synonyms Comment Organism
BChE
-
Equus caballus
butyrylcholinesterase
-
Equus caballus

Temperature Optimum [°C]

Temperature Optimum [°C] Temperature Optimum Maximum [°C] Comment Organism
25
-
assay at Equus caballus

pH Optimum

pH Optimum Minimum pH Optimum Maximum Comment Organism
7.5
-
assay at Equus caballus

Ki Value [mM]

Ki Value [mM] Ki Value maximum [mM] Inhibitor Comment Organism Structure
0.001
-
di-n-butyl 3,5-dimethylphenyl phosphate pH 7.5, 25°C Equus caballus
0.0019
-
di-n-butyl 2-naphthyl phosphate pH 7.5, 25°C Equus caballus
0.002
-
benzyl di-n-butyl phosphate pH 7.5, 25°C Equus caballus
0.008
-
di-n-butyl 4-methylphenyl phosphate pH 7.5, 25°C Equus caballus
0.009
-
di-n-butyl 3,4-dimethylphenyl phosphate pH 7.5, 25°C Equus caballus
0.011
-
di-n-butyl 3,4,5-trimethylphenyl phosphate pH 7.5, 25°C Equus caballus
0.014
-
di-n-butyl 4-methylbenzyl phosphate pH 7.5, 25°C Equus caballus
0.016
-
di-n-butyl 3-methylphenyl phosphate pH 7.5, 25°C Equus caballus
0.022
-
di-n-butyl naphthalen-1-yl phosphate pH 7.5, 25°C Equus caballus
0.024
-
di-n-butyl 3-methylbenzyl phosphate pH 7.5, 25°C Equus caballus
0.05
-
di-n-butyl 2-methylphenyl phosphate pH 7.5, 25°C Equus caballus
0.053
-
di-n-butyl 2-phenylethyl phosphate pH 7.5, 25°C Equus caballus
0.072
-
di-n-butyl 2-methylbenzyl phosphate pH 7.5, 25°C Equus caballus