Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0I8HK
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| Former ID |
DNC007316
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| Drug Name |
1-(2'-chlorophenyl)penta-1,4-dien-3-one
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| Synonyms |
CHEMBL224976; BDBM50177103; 1,4-Pentadien-3-one, 1-(2-chlorophenyl)-; 1-(2''-chlorophenyl)penta-1,4-dien-3-one
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C11H9ClO
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| Canonical SMILES |
C=CC(=O)C=CC1=CC=CC=C1Cl
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| InChI |
1S/C11H9ClO/c1-2-10(13)8-7-9-5-3-4-6-11(9)12/h2-8H,1H2/b8-7+
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| InChIKey |
DIYSCNLXRVKMMK-BQYQJAHWSA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Glutathione reductase (GR) | Target Info | Inhibitor | [1] |
| Trypanosoma Trypanothione reductase (Trypano TPR) | Target Info | Inhibitor | [1] | |
| BioCyc | Glutathione redox reactions II | |||
| Glutathione redox reactions I | ||||
| KEGG Pathway | Glutathione metabolism | |||
| Thyroid hormone synthesis | ||||
| Pathwhiz Pathway | Glutamate Metabolism | |||
| Glutathione Metabolism | ||||
| WikiPathways | Metapathway biotransformation | |||
| Sulfation Biotransformation Reaction | ||||
| Oxidative Stress | ||||
| NRF2 pathway | ||||
| Nuclear Receptors Meta-Pathway | ||||
| Selenium Micronutrient Network | ||||
| Glutathione metabolism | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Irreversible inactivation of trypanothione reductase by unsaturated Mannich bases: a divinyl ketone as key intermediate. J Med Chem. 2005 Nov 17;48(23):7400-10. | |||
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