An In-silico Approach to Design and Validate siRNA against Monkeypox Virus

Author:

Dhotre Kishore1,Banerjee Anwesha1,Dass Debashree1,Nema Vijay2,Mukherjee Anupam1ORCID

Affiliation:

1. Division of Virology, ICMR-National AIDS Research Institute, Pune 411026, Maharashtra, India

2. Molecular Biology, National AIDS Research Institute, Pune 411026, India

Abstract

Introduction: The monkeypox virus has emerged as an uncommon zoonotic infection. The recent outbreak of MPXV in Europe and abroad in 2022 presented a major threat to individuals at risk. At present, no specific MPXV vaccinations or medications are available. Methods: In this study, we predicted the most effective siRNA against the conserved region of the MPXV and validated the activity by performing molecular docking studies. Results: Ultimately, the most efficient siRNA molecule was shortlisted against the envelope protein gene (B6R) based on its toxicity, effectivity, thermodynamic stability, molecular interaction, and molecular dynamics simulations (MD) with the Human Argonaute 2 protein. Conclusion: Thus, the strategy may offer a platform for the development of potential antiviral RNA therapeutics that target MPXV at the genomic level.

Publisher

Bentham Science Publishers Ltd.

Subject

Drug Discovery,Pharmacology

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