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Literature summary extracted from

  • Mao, J.; Eoh, H.; He, R.; Wang, Y.; Wan, B.; Franzblau, S.G.; Crick, D.C.; Kozikowski, A.P.
    Structure-activity relationships of compounds targeting mycobacterium tuberculosis 1-deoxy-D-xylulose 5-phosphate synthase (2008), Bioorg. Med. Chem. Lett., 18, 5320-5323.
    View publication on PubMedView publication on EuropePMC

Cloned(Commentary)

EC Number Cloned (Comment) Organism
2.2.1.7 expression in Escherichia coli Mycobacterium tuberculosis

Inhibitors

EC Number Inhibitors Comment Organism Structure
2.2.1.7 2-methyl-3,5-diphenyl-6-propylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 2-methyl-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 2-methyl-5-naphthalen-2-yl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3,5-bis(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3,5-diphenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-bromophenyl)-5-(2-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-bromophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-2-ethyl-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-2-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-2-methyl-5-[[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl]pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-(methoxymethyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-chlorophenyl)-5-[[(4-chlorophenyl)sulfanyl]methyl]-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-fluorophenyl)-5-(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-methoxyphenyl)-2-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 3-(4-methoxyphenyl)-5-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 5-benzyl-3-(4-chlorophenyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 5-benzyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 5-benzyl-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 5-[[(4-chlorophenyl)sulfanyl]methyl]-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
-
 Mycobacterium tuberculosis
2.2.1.7 ethyl (5-methyl-7-oxo-3-phenyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate
-
 Mycobacterium tuberculosis
2.2.1.7 methyl [3-(4-bromophenyl)-7-oxo-2-(trifluoromethyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate
-
 Mycobacterium tuberculosis

Molecular Weight [Da]

EC Number Molecular Weight [Da] Molecular Weight Maximum [Da] Comment Organism
2.2.1.7 67800
-
 SDS-PAGE Mycobacterium tuberculosis

Organism

EC Number Organism UniProt Comment Textmining
2.2.1.7 Mycobacterium tuberculosis
-
-
-

Purification (Commentary)

EC Number Purification (Comment) Organism
2.2.1.7 95% pure by SDS-PAGE Mycobacterium tuberculosis

Synonyms

EC Number Synonyms Comment Organism
2.2.1.7 1-deoxy-D-xylulose 5-phosphate synthase
-
 Mycobacterium tuberculosis
2.2.1.7 DXS
-
 Mycobacterium tuberculosis

IC50 Value

EC Number IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
2.2.1.7 0.0106
-
-
 Mycobacterium tuberculosis 3-(4-fluorophenyl)-5-(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0109
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.014
-
-
 Mycobacterium tuberculosis 5-benzyl-3-(4-chlorophenyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0195
-
-
 Mycobacterium tuberculosis 2-methyl-5-naphthalen-2-yl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0197
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-2-ethyl-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0202
-
-
 Mycobacterium tuberculosis 3-(4-methoxyphenyl)-5-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.023
-
-
 Mycobacterium tuberculosis 3,5-diphenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0306
-
-
 Mycobacterium tuberculosis 2-methyl-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0342
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-2-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0411
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-[[(4-chlorophenyl)sulfanyl]methyl]-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0424
-
-
 Mycobacterium tuberculosis 3,5-bis(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0535
-
-
 Mycobacterium tuberculosis 3-(4-bromophenyl)-5-(2-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0551
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-2-methyl-5-[[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl]pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0637
-
-
 Mycobacterium tuberculosis 5-[[(4-chlorophenyl)sulfanyl]methyl]-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0711
-
-
 Mycobacterium tuberculosis 5-benzyl-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0719
-
-
 Mycobacterium tuberculosis 2-methyl-3,5-diphenyl-6-propylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.073
-
-
 Mycobacterium tuberculosis methyl [3-(4-bromophenyl)-7-oxo-2-(trifluoromethyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate
2.2.1.7 0.0907
-
-
 Mycobacterium tuberculosis 3-(4-methoxyphenyl)-2-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.0984
-
-
 Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.1141
-
-
 Mycobacterium tuberculosis 5-benzyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 3-(4-methoxyphenyl)-5-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis ethyl (5-methyl-7-oxo-3-phenyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 3-(4-bromophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
2.2.1.7 0.2
-
 value above Mycobacterium tuberculosis 3-(4-chlorophenyl)-5-(methoxymethyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one