The potential of Abrus precatorius leaves in arthritis alleviation computational approaches through lC-MS analysis
Year: 2025
Type: article
Abstract: AIM: leaves in arthritis treatment using computational methods and LC-MS analysis. METHODS: The plant material was taxonomically authenticated, and phytochemical analysis identified bioactive compounds such as alkaloids, flavonoids, and triterpenoids. RESULTS: Swiss ADME analysis confirmed that multiple compounds complied with Lipinski's Rule of Five, while OSIRIS software indicated minimal toxicity. PASS analysis predicted anti-inflammatory and antioxidant activities. Molecular docking simulations of Abrine with key rheumatoid arthritis (RA) targets revealed strong binding affinities, suggesting potential mechanisms for RA treatment. CONCLUSION: leaves and emphasizes the importance of computational tools in understanding their pharmacological properties for arthritis management.
Source: Future Science OA
Authors: Sukanya Vijayan, Thirumal Margesan
Institutions: SRM Institute of Science and Technology, SRM University
Language: English
Subfield: Computational Theory and Mathematics
Field: Computer Science
Domain: Physical Sciences
Open Access status: gold
Estimated APC paid: $1,165
OpenAlex ID: W4408846004