Khan, Al' aina Yuhainis Firus and Ahmed, Qamar Uddin and Khatib, Alfi and Ibrahim, Zalikha and Nipun, Tanzina Sharmin and Natto, Hatim Abdullah and Saiman, Mohd Zuwairi and Zakaria, Zainul Amiruddin and Wahab, Ridhwan Abdul (2024) Identification of cancer inhibitors from Hystrix brachyura bezoar extracts using LC-MS multivariate data analysis and in silico evaluation on Bcl-2, cyclin B/CDK1, VEGF and NM23-H1. BOLETIN LATINOAMERICANO Y DEL CARIBE DE PLANTAS MEDICINALES Y AROMATICAS, 23 (1). pp. 41-60. DOI https://doi.org/10.37360/blacpma.24.23.1.4.
Full text not available from this repository.Abstract
Hystrix brachyura bezoar is calcified undigested material found in the gastrointestinal tract known for various medicinal benefits including as an anticancer agent. However, the H. brachyura population has been declining due to its demand and is under Malaysian law protection. Therefore, present study aimed to identify bezoar anticancer active compounds through metabolomics and in-silico approaches. Five replicates of bezoar powder were subjected to extraction using different solvent ratios of methanol-water (100, 75, 50, 25, 0% v/v). Cytotoxicity and metabolite profiling using liquid chromatography-mass spectrometry were conducted. Putative compounds identified were subjected to in-silico analysis with targeted anticancer proteins namely, Bcl-2, Cyclin B/CDK1 complex, VEGF and NM23-H1. The correlation of LC-MS and cytotoxicity profile pinpointed two compounds, mangiferin and propafenone. In-silico study showed both compounds exerted good binding scores to all proteins with hydrophobic interaction dominating the ligand-protein complex binding, suggesting the ligands act as hydrophobes in the interactions.
| Item Type: | Article |
|---|---|
| Funders: | Ministry of Higher Education (MOHE) , Malaysia [FRGS 16-045-0544] |
| Uncontrolled Keywords: | Hystrix brachyura; Anticancer; LCMS; Metabolomics; Molecular docking |
| Subjects: | Q Science > QR Microbiology R Medicine > R Medicine (General) |
| Divisions: | Faculty of Science > Institute of Biological Sciences Deputy Vice Chancellor (Research & Innovation) Office > Centre for Research in Biotechnology for Agriculture |
| Depositing User: | Ms. Juhaida Abd Rahim |
| Date Deposited: | 20 Jun 2024 01:40 |
| Last Modified: | 20 Jun 2024 01:40 |
| URI: | http://eprints.um.edu.my/id/eprint/44197 |
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