Unveiling Natural and Semisynthetic Acylated Flavonoids: Chemistry and Biological Actions in the Context of Molecular Docking.
Dina M El-KershRania F Abou El-EzzMarwa Ahmed FouadMohamed Ali FaragPublished in: Molecules (Basel, Switzerland) (2022)
Acylated flavonoids are widely distributed natural metabolites in medicinal plants and foods with several health attributes. A large diversity of chemical structures of acylated flavonoids with interesting biological effects was reported from several plant species. Of these, 123 compounds with potential antimicrobial, antiparasitic, anti-inflammatory, anti-nociceptive, analgesic, and anti-complementary effects were selected from several databases including SCI-Finder, Scopus, Google Scholar, Science Direct, PubMed, and others. Some selected reported biologically active flavonoids were docked in the active binding sites of some natural enzymes, namely acetylcholinesterase, butyrylcholinesterase, α-amylase, α-glucosidase, aldose reductase, and HIV integrase, in an attempt to underline the key interactions that might be responsible for their biological activities.
Keyphrases
- molecular docking
- anti inflammatory
- public health
- healthcare
- molecular dynamics simulations
- spinal cord injury
- neuropathic pain
- mental health
- hiv positive
- staphylococcus aureus
- hiv infected
- human immunodeficiency virus
- hepatitis c virus
- machine learning
- high resolution
- hiv testing
- men who have sex with men
- hiv aids
- mass spectrometry
- deep learning
- health promotion