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All Journal CRJIM (Clinical and Research Journal in Internal Medicine)
Syaban, Mokhamad Fahmi Rizki
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Education Health Professions Immunology & microbiology Medicine & Pharmacology Nursing Public Health Other

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Allium Sativum As Antimalaria Agent Via Falciapin Protease-2 Inhibitor Mechanism : Molecular Docking Perspective Syaban, Mokhamad Fahmi Rizki; Rachman, Hafidh Alyza; Arrahman, Azmirfani Diti; Hudayana, Nur; Khamid, Jaya Purna; Pratama, Farhan Adi
Clinical and Research Journal in Internal Medicine Vol 2, No 1 (2021): First Issue of 2021
Publisher : Universitas Brawijaya

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.21776/ub.crjim.2021.002.01.4

Abstract

Background: Malaria is an endemic disease that can lead to death. Malaria control is a threatening cause of resistance to antimalarial drugs so that renewable therapies are needed to overcome this disease. The chemical compounds of garlic have potential as antimalarial agents, but the mechanism is still unknown. Aim: This research will predict the compounds' molecular mechanism in garlic (Allium sativum) using the in-silico method. Methods: The In-silico method using chemical compounds in Allium sativum were obtained from PubChem, and Falciapain protease-2 was obtained from the Protein Data Bank. Then performed a docking simulation between ligand-protein and analyzed it in 3D. We were used PyRx, Pymol, and DS (Discover Studio) software for analysis and visualization of the interaction of ligand-protein. Results: The results we got, the Alliin compound contained in Allium sativum has the strongest bond with Falcipain protease-2. Allin has fulfilled Lipinski Rule, so Alliin drug-likeness potentially. Alliin has antimalarial activity with its inhibition mechanism against Falcipain protease-2. Conclusion:  We recommend this study as a reference for further research on Aliin compounds as antimalarials through in vitro and in vivo methods.
Co-Authors Arrahman, Azmirfani Diti Hudayana, Nur Khamid, Jaya Purna Pratama, Farhan Adi Rachman, Hafidh Alyza