Published September 14, 2023
| Version v1
Journal article
Open
Antioxidant Effect of Naringin Demonstrated through a Bayes' Theorem Driven Multidisciplinary Approach Reveals its Prophylactic Potential as a Dietary Supplement for Ischemic Stroke
Creators
- 1. Division of Neroscience, Yenepoya Research Centre, Yenepoya (Deemed to be University)
- 2. Data Analytics, Bioinformatis and Structural Biology division, Yenepoya Research Center, Yenepoya (Deemed to be University),
- 3. Department of Biological Sciences, Indian Institute of Science Education and Research, Bhopal
- 4. School of Biosciences, Mahatma Gandhi University
- 5. Yenepoya Pharmacy College and Research Center, Ayush campus
- 6. Father Muller Research Center, Father Muller Medical College
- 7. Department of Neurology, Yenepoya Medical College, Yenepoya (Deemed to be University),
Description
An interdisciplinary approach involving Bayesian calculations, in vitro experiments on cell lines exhibiting oxygen-glucose deprivation and molecular docking and simulations was employed to investigate the cytoprotective effect of Naringin, a flavonoid derivative present in numerous foods such as citrus fruits, grape juice and rasam. From the Bayesian calculations, CDK1 kinase was identified as one of the potential targets to which Naringin binds. Docking calculations and molecular dynamics showed that the Naringin bound to the ATP-binding cavity of CDK1 stably, and substantially affected the solvent accessibility of the residues of ATP-binding cavity.