Kaempferol as a novel inhibitor of SARS-CoV-2 RNA-dependent RNA polymerase.

RNA‐dependent RNA polymerase SARS‐CoV‐2 enzymatic activity kaempferol molecular docking and dynamics simulations

Journal

Journal of biomolecular structure & dynamics
ISSN: 1538-0254
Titre abrégé: J Biomol Struct Dyn
Pays: England
ID NLM: 8404176

Informations de publication

Date de publication:
11 Sep 2024
Historique:
medline: 11 9 2024
pubmed: 11 9 2024
entrez: 11 9 2024
Statut: aheadofprint

Résumé

Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) has quickly become a global health pandemic. Among the viral proteins, RNA-dependent RNA polymerase (RdRp) is responsible for viral genome replication and has emerged as a promising target against SARS-CoV-2 infection. Dietary bioactive compounds represent an important source of evolutionarily optimized molecules with antiviral properties against SARS-CoV-2 RdRp. We investigated the inhibitory potential effects of different phytochemicals against SARS-CoV-2 RdRp, including andrographolide, kaempferol, resveratrol, and silibinin. Unlike the other investigated compounds, kaempferol exhibited a significant dose-dependent

Identifiants

pubmed: 39258938
doi: 10.1080/07391102.2024.2402695
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

1-10

Auteurs

Alessandro Medoro (A)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Francesca Benedetti (F)

Institute of Human Virology, University of Maryland, School of Medicine, Baltimore, MD, USA.
Department of Biochemistry and Molecular Biology, University of Maryland, School of Medicine, Baltimore, MD, USA.

Mariano Intrieri (M)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Tassadaq Hussain Jafar (TH)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Sawan Ali (S)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Truong Tan Trung (TT)

Laboratory of Computation and Nanoscience, Dong Nai Technology University, Dong Nai, Vietnam.

Daniela Passarella (D)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Saba Ismail (S)

National University of Medical Sciences, Islamabad, Pakistan.

Davide Zella (D)

Institute of Human Virology, University of Maryland, School of Medicine, Baltimore, MD, USA.
Department of Biochemistry and Molecular Biology, University of Maryland, School of Medicine, Baltimore, MD, USA.

Giovanni Scapagnini (G)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Sergio Davinelli (S)

Department of Medicine and Health Sciences "V. Tiberio", University of Molise, Campobasso, Italy.

Classifications MeSH