Neem and Turmeric in the management of Covid Associated Mucormycosis (CAM) derived through network pharmacology. Issue 8 (24th May 2023)

• Record Type: Journal Article
• Authors: Datta, Sutapa; Sarkar, Indrani; Sen, Gargi; Sen, Arnab
• Is Part Of: Journal of biomolecular structure & dynamics. Volume 41:Issue 8(2023)
• Page Start: 3281
• Page End: 3294
• Publication Date: 2023-05-24
• Subjects: Covid Associated Mucormycosis (CAM) -- network pharmacology -- Neem -- Turmeric -- protein protein interaction (PPI) network; Biomolecules -- Periodicals; Molecular structure -- Periodicals; Molecular Biology -- Periodicals; Biomechanics -- Periodicals; 572
• DOI: 10.1080/07391102.2022.2048077
• Languages: English
• ISSNs: 0739-1102

Abstract

Abstract: Mucormycosis or 'Black Fungus' has been known to target immunocompromised individuals even before the emergence of COVID-19. Nevertheless, the present circumstances provide the best opening for Covid Associated Mucormycosis (CAM), as the global pandemic is engulfing a large part of human population making them immunocompromised. This drastic increase in Mucormycosis infections has to be addressed as early as possible. There is a growing tendency of relying upon herbal drugs that have minimal side effects and does not compromise our immune system. Recently, the concept of network pharmacology has grabbed the attention of modern science, especially advanced medical sciences. This is a new discipline that can use computational power to systematically catalogue the molecular interactions between botanical formulations and the human body. In this study, Neem and Turmeric was considered as the target plants and an attempt was made to reveal various aspects through which phytocompounds derived from them may effectively manage CAM menace. We have taken a step-by-step approach for identifying the target proteins and ligands associated with Mucormycosis treatment. Functional network analysis and Molecular docking approaches were applied to validate our findings. Quercetin derived from both Neem and Turmeric was found to be one of the main phytocompounds working against Mucormycosis. Along with that, Caffeic acid, Curcumin, Kaempferol, Tetrahydrocurcumin and Myricetin also play a pivotal role in fighting against Black-Fungus. A thorough analysis of our result suggested a triple-front attack on the fungal pathogens and the approaches are necrosis inhibition, iron chelation and immuno-boosting. Communicated by Ramaswamy H. Sarma