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Metabolomics and
- Source :
- Analytical chemistry. 93(6)
- Publication Year :
- 2021
-
Abstract
- The identification of target proteins for small molecules is of great importance in drug discovery and for understanding the cellular mode of action (MOA) of toxicants. Herein, a "bottom-up" oriented target finding strategy is proposed based on the principle that the targeted enzymes can be inferred according to their phenotypic changes at the metabolome level. Meanwhile, computer-assisted
- Subjects :
- Molecular Docking Simulation
Metabolome
Metabolomics
Computer Simulation
Calorimetry
Subjects
Details
- ISSN :
- 15206882
- Volume :
- 93
- Issue :
- 6
- Database :
- OpenAIRE
- Journal :
- Analytical chemistry
- Accession number :
- edsair.pmid..........c1cb48adf0a5c3e4382dafa7ee2bc7cb