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New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins

Respiratory syncytial virus (RSV) causes annual epidemics of respiratory infection. Usually harmless to adults, the RSV infection can be dangerous to children under 3 years of age and elderly people over 65 years of age, often causing serious problems, even death. At present, there are no vaccines a...

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Autores principales: Khomenko, Tatyana M., Shtro, Anna A., Galochkina, Anastasia V., Nikolaeva, Yulia V., Garshinina, Anzhelika V., Borisevich, Sophia S., Korchagina, Dina V., Volcho, Konstantin P., Salakhutdinov, Nariman F.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10054240/
https://www.ncbi.nlm.nih.gov/pubmed/36985645
http://dx.doi.org/10.3390/molecules28062673
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author Khomenko, Tatyana M.
Shtro, Anna A.
Galochkina, Anastasia V.
Nikolaeva, Yulia V.
Garshinina, Anzhelika V.
Borisevich, Sophia S.
Korchagina, Dina V.
Volcho, Konstantin P.
Salakhutdinov, Nariman F.
author_facet Khomenko, Tatyana M.
Shtro, Anna A.
Galochkina, Anastasia V.
Nikolaeva, Yulia V.
Garshinina, Anzhelika V.
Borisevich, Sophia S.
Korchagina, Dina V.
Volcho, Konstantin P.
Salakhutdinov, Nariman F.
author_sort Khomenko, Tatyana M.
collection PubMed
description Respiratory syncytial virus (RSV) causes annual epidemics of respiratory infection. Usually harmless to adults, the RSV infection can be dangerous to children under 3 years of age and elderly people over 65 years of age, often causing serious problems, even death. At present, there are no vaccines and specific chemotherapeutic agents for the treatment of this disease, so the search for low-molecular weight compounds to combat RSV is a challenge. In this work, we have shown, for the first time, that monoterpene-substituted arylcoumarins are efficient RSV replication inhibitors at low micromolar concentrations. The most active compound has a selectivity index of about 200 and acts most effectively at the early stages of infection. The F protein of RSV is a potential target for these compounds, which is also confirmed by molecular docking and molecular dynamics simulation data.
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spelling pubmed-100542402023-03-30 New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins Khomenko, Tatyana M. Shtro, Anna A. Galochkina, Anastasia V. Nikolaeva, Yulia V. Garshinina, Anzhelika V. Borisevich, Sophia S. Korchagina, Dina V. Volcho, Konstantin P. Salakhutdinov, Nariman F. Molecules Article Respiratory syncytial virus (RSV) causes annual epidemics of respiratory infection. Usually harmless to adults, the RSV infection can be dangerous to children under 3 years of age and elderly people over 65 years of age, often causing serious problems, even death. At present, there are no vaccines and specific chemotherapeutic agents for the treatment of this disease, so the search for low-molecular weight compounds to combat RSV is a challenge. In this work, we have shown, for the first time, that monoterpene-substituted arylcoumarins are efficient RSV replication inhibitors at low micromolar concentrations. The most active compound has a selectivity index of about 200 and acts most effectively at the early stages of infection. The F protein of RSV is a potential target for these compounds, which is also confirmed by molecular docking and molecular dynamics simulation data. MDPI 2023-03-15 /pmc/articles/PMC10054240/ /pubmed/36985645 http://dx.doi.org/10.3390/molecules28062673 Text en © 2023 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Khomenko, Tatyana M.
Shtro, Anna A.
Galochkina, Anastasia V.
Nikolaeva, Yulia V.
Garshinina, Anzhelika V.
Borisevich, Sophia S.
Korchagina, Dina V.
Volcho, Konstantin P.
Salakhutdinov, Nariman F.
New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title_full New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title_fullStr New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title_full_unstemmed New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title_short New Inhibitors of Respiratory Syncytial Virus (RSV) Replication Based on Monoterpene-Substituted Arylcoumarins
title_sort new inhibitors of respiratory syncytial virus (rsv) replication based on monoterpene-substituted arylcoumarins
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10054240/
https://www.ncbi.nlm.nih.gov/pubmed/36985645
http://dx.doi.org/10.3390/molecules28062673
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