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Literature summary extracted from
- Discovery and structure optimization of a series of isatin derivatives as Mycobacterium tuberculosis chorismate mutase inhibitors (2014), Chem. Biol. Drug Des., 83, 498-506 .
Inhibitors
| EC Number | Inhibitors | Comment | Organism | Structure |
|---|---|---|---|---|
| 5.4.99.5 | (Z)-3-((5-nitrothiazol-2-yl)imino)indolin-2-one | - |
Mycobacterium tuberculosis |  |
| 5.4.99.5 | (Z)-3-((6-nitrobenzo[d]thiazol-2-yl)imino)indolin-2-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | (Z)-3-(hydroxyimino)indolin-2-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | (Z)-N-(1-acetyl-2-oxoindolin-3-ylidene)hydrazinecarbothioamide | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | (Z)-N-(1-acetyl-2-oxoindolin-3-ylidene)hydrazinecarboxamide | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | (Z)-N-(2-oxoindolin-3-ylidene)hydrazinecarbothioamide | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | (Z)-N-(2-oxoindolin-3-ylidene)hydrazinecarboxamide | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-(prop-1-en-2-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-acetylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-ethylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-isopropylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-methylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-phenylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 1-pivaloylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 2-chloro-3-(5,6-difluoro-1H-indol-3-yl)quinoxaline | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 3-((5-nitrothiophen-2-yl)methylene)indolin-2-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 3-(3-methoxyphenyl)-5,6,7,8-tetrahydrobenzo[b]thieno[2,3d]pyrimidin-4[3H]-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 3-(4-nitrobenzylidene)indolin-2-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 3-amino-1-(3-(4-hydroxybut-1-yn-1-yl)phenyl)-1H-benzol[f]chromene-2-carbonitril | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 4-(3,4-dimethoxyphenethylamino)-3-nitro-5-sulfamoylbenzoic acid | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(2,3-dichlorophenyl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(2,5-dimethylphenyl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(4-(3-(tert-butyl)phenyl)piperazin-1-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(4-(furan-2-carbonyl)piperazin-1-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(4-methylpiperazin-1-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(piperazin-1-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-(piperidin-1-yl)indoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-naphthyl-7-propyl-3H-pyrazolo-[4,3-d][1,2,3]triazin-4[5h]-one | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | 5-phenylindoline-2,3-dione | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | ethambutol | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | isatin | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | isoniazid | - |
Mycobacterium tuberculosis | |
| 5.4.99.5 | additional information | discovery and structure optimization of a series of isatin derivatives as Mycobacterium tuberculosis chorismate mutase inhibitors, synthesis of enzyme inhibitors, overview | Mycobacterium tuberculosis | |
| 5.4.99.5 | rifampicin | - |
Mycobacterium tuberculosis | |
Natural Substrates/ Products (Substrates)
| EC Number | Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
|---|---|---|---|---|---|---|---|
| 5.4.99.5 | Chorismate | Mycobacterium tuberculosis | - |
Prephenate | - |
? | |
Organism
| EC Number | Organism | UniProt | Comment | Textmining |
|---|---|---|---|---|
| 5.4.99.5 | Mycobacterium tuberculosis | - |
- |
- |
Substrates and Products (Substrate)
| EC Number | Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
|---|---|---|---|---|---|---|---|
| 5.4.99.5 | Chorismate | - |
Mycobacterium tuberculosis | Prephenate | - |
? | |
Synonyms
| EC Number | Synonyms | Comment | Organism |
|---|---|---|---|
| 5.4.99.5 | MTB chorismate mutase | - |
Mycobacterium tuberculosis |
| 5.4.99.5 | MTB CM | - |
Mycobacterium tuberculosis |
IC50 Value
| EC Number | IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
|---|---|---|---|---|---|---|
| 5.4.99.5 | 0.00093 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 3-((5-nitrothiophen-2-yl)methylene)indolin-2-one | |
| 5.4.99.5 | 0.00099 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-acetylindoline-2,3-dione | |
| 5.4.99.5 | 0.00101 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 3-(4-nitrobenzylidene)indolin-2-one | |
| 5.4.99.5 | 0.00108 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | isatin | |
| 5.4.99.5 | 0.00196 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-methylindoline-2,3-dione | |
| 5.4.99.5 | 0.01513 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-naphthyl-7-propyl-3H-pyrazolo-[4,3-d][1,2,3]triazin-4[5h]-one | |
| 5.4.99.5 | 0.01563 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 3-amino-1-(3-(4-hydroxybut-1-yn-1-yl)phenyl)-1H-benzol[f]chromene-2-carbonitril | |
| 5.4.99.5 | 0.01974 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 2-chloro-3-(5,6-difluoro-1H-indol-3-yl)quinoxaline | |
| 5.4.99.5 | 0.0198 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 3-(3-methoxyphenyl)-5,6,7,8-tetrahydrobenzo[b]thieno[2,3d]pyrimidin-4[3H]-one | |
| 5.4.99.5 | 0.0227 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-ethylindoline-2,3-dione | |
| 5.4.99.5 | 0.0233 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-phenylindoline-2,3-dione | |
| 5.4.99.5 | 0.025 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-N-(1-acetyl-2-oxoindolin-3-ylidene)hydrazinecarboxamide | |
| 5.4.99.5 | 0.0256 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(4-(furan-2-carbonyl)piperazin-1-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.0288 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(piperidin-1-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.0305 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-N-(1-acetyl-2-oxoindolin-3-ylidene)hydrazinecarbothioamide | |
| 5.4.99.5 | 0.0319 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(4-methylpiperazin-1-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.0365 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(2,5-dimethylphenyl)indoline-2,3-dione | |
| 5.4.99.5 | 0.0371 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-phenylindoline-2,3-dione | |
| 5.4.99.5 | 0.0399 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(piperazin-1-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.041 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-pivaloylindoline-2,3-dione | |
| 5.4.99.5 | 0.0541 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-N-(2-oxoindolin-3-ylidene)hydrazinecarboxamide | |
| 5.4.99.5 | 0.0557 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(4-(3-(tert-butyl)phenyl)piperazin-1-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.0669 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-N-(2-oxoindolin-3-ylidene)hydrazinecarbothioamide | |
| 5.4.99.5 | 0.07512 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-isopropylindoline-2,3-dione | |
| 5.4.99.5 | 0.0957 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 5-(2,3-dichlorophenyl)indoline-2,3-dione | |
| 5.4.99.5 | 0.09656 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | 1-(prop-1-en-2-yl)indoline-2,3-dione | |
| 5.4.99.5 | 0.09814 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-3-(hydroxyimino)indolin-2-one | |
| 5.4.99.5 | 0.1 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-3-((5-nitrothiazol-2-yl)imino)indolin-2-one | |
| 5.4.99.5 | 0.1 | - |
pH and temperature not specified in the publication | Mycobacterium tuberculosis | (Z)-3-((6-nitrobenzo[d]thiazol-2-yl)imino)indolin-2-one | |
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