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Literature summary for 1.13.11.33 extracted from

  • Bakavoli, M.; Sadeghian, H.; Tabatabaei, Z.; Rezaei, E.; Rahimizadeh, M.; Nikpour, M.
    SAR comparative studies on pyrimido[4,5-b][1,4] benzothiazine derivatives as 15-lipoxygenase inhibitors, using ab initio calculations (2008), J. Mol. Model., 14, 471-478.
    View publication on PubMed
Search for more literature for 1.13.11.33

Inhibitors

Inhibitors Comment Organism Structure
2-(4-ethylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
2-(4-methylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
2-(4-methylpiperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
2-(morpholin-4-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
2-(piperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
2-(pyrrolidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(4-ethylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(4-methylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(4-methylpiperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(morpholin-4-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(piperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
4-methyl-2-(pyrrolidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
-
 Glycine max
additional information docking experiments and structure activity relationship, comparative studies, comparison with the crystal structure with PDB entry: 1IK3, EC 1.13.11.12, overview Glycine max

Organism

Organism UniProt Comment Textmining
Glycine max
-
-
-

Substrates and Products (Substrate)

Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
linoleic acid + O2
-
 Glycine max ?
-
 ?

Synonyms

Synonyms Comment Organism
15-lipoxygenase
-
 Glycine max
15-LO
-
 Glycine max
More cf. EC 1.13.11.12 Glycine max

Temperature Optimum [°C]

Temperature Optimum [°C] Temperature Optimum Maximum [°C] Comment Organism
20
-
 assay at Glycine max

pH Optimum

pH Optimum Minimum pH Optimum Maximum Comment Organism
9
-
 assay at Glycine max

Ki Value [mM]

Ki Value [mM] Ki Value maximum [mM] Inhibitor Comment Organism Structure
additional information
-
 additional information docking experiments and structure activity relationship comparative studies, estimated inhibition constants, calculated in autodock, overview Glycine max

IC50 Value

IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
0.018
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(4-methylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.036
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(4-ethylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.048
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(pyrrolidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.058
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(piperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.058
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(morpholin-4-yl)pyrimido[4,5-b][1,4]benzothiazine
0.076
-
 pH 9.0, 20°C Glycine max 4-methyl-2-(4-methylpiperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.14
-
 pH 9.0, 20°C Glycine max 2-(morpholin-4-yl)pyrimido[4,5-b][1,4]benzothiazine
0.146
-
 pH 9.0, 20°C Glycine max 2-(piperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.18
-
 pH 9.0, 20°C Glycine max 2-(4-methylpiperidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.216
-
 pH 9.0, 20°C Glycine max 2-(pyrrolidin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.235
-
 pH 9.0, 20°C Glycine max 2-(4-ethylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine
0.267
-
 pH 9.0, 20°C Glycine max 2-(4-methylpiperazin-1-yl)pyrimido[4,5-b][1,4]benzothiazine