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Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant

Earlier studies with montelukast (M) and telmisartan (T) have revealed their potential antiviral properties against SARS-CoV-2 wild-type (WT) but have not assessed their efficacy against emerging Variants of Concern (VOCs) such as Omicron. Our research fills this gap by investigating these drugs’ im...

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Autores principales: Mulgaonkar, Nirmitee, Wang, Haoqi, Zhang, Junrui, Roundy, Christopher M., Tang, Wendy, Chaki, Sankar Prasad, Pauvolid-Corrêa, Alex, Hamer, Gabriel L., Fernando, Sandun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10385313/
https://www.ncbi.nlm.nih.gov/pubmed/37514075
http://dx.doi.org/10.3390/pharmaceutics15071891
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author Mulgaonkar, Nirmitee
Wang, Haoqi
Zhang, Junrui
Roundy, Christopher M.
Tang, Wendy
Chaki, Sankar Prasad
Pauvolid-Corrêa, Alex
Hamer, Gabriel L.
Fernando, Sandun
author_facet Mulgaonkar, Nirmitee
Wang, Haoqi
Zhang, Junrui
Roundy, Christopher M.
Tang, Wendy
Chaki, Sankar Prasad
Pauvolid-Corrêa, Alex
Hamer, Gabriel L.
Fernando, Sandun
author_sort Mulgaonkar, Nirmitee
collection PubMed
description Earlier studies with montelukast (M) and telmisartan (T) have revealed their potential antiviral properties against SARS-CoV-2 wild-type (WT) but have not assessed their efficacy against emerging Variants of Concern (VOCs) such as Omicron. Our research fills this gap by investigating these drugs’ impact on VOCs, a topic that current scientific literature has largely overlooked. We employed computational methodologies, including molecular mechanics and machine learning tools, to identify drugs that could potentially disrupt the SARS-CoV-2 spike RBD-ACE2 protein interaction. This led to the identification of two FDA-approved small molecule drugs, M and T, conventionally used for treating asthma and hypertension, respectively. Our study presents an additional potential use for these drugs as antivirals. Our results show that both M and T can inhibit not only the WT SARS-CoV-2 but also, in the case of M, the Omicron variant, without reaching cytotoxic concentrations. This novel finding fills an existing gap in the literature and introduces the possibility of repurposing these drugs for SARS-CoV-2 VOCs, an essential step in responding to the evolving global pandemic.
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spelling pubmed-103853132023-07-30 Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant Mulgaonkar, Nirmitee Wang, Haoqi Zhang, Junrui Roundy, Christopher M. Tang, Wendy Chaki, Sankar Prasad Pauvolid-Corrêa, Alex Hamer, Gabriel L. Fernando, Sandun Pharmaceutics Article Earlier studies with montelukast (M) and telmisartan (T) have revealed their potential antiviral properties against SARS-CoV-2 wild-type (WT) but have not assessed their efficacy against emerging Variants of Concern (VOCs) such as Omicron. Our research fills this gap by investigating these drugs’ impact on VOCs, a topic that current scientific literature has largely overlooked. We employed computational methodologies, including molecular mechanics and machine learning tools, to identify drugs that could potentially disrupt the SARS-CoV-2 spike RBD-ACE2 protein interaction. This led to the identification of two FDA-approved small molecule drugs, M and T, conventionally used for treating asthma and hypertension, respectively. Our study presents an additional potential use for these drugs as antivirals. Our results show that both M and T can inhibit not only the WT SARS-CoV-2 but also, in the case of M, the Omicron variant, without reaching cytotoxic concentrations. This novel finding fills an existing gap in the literature and introduces the possibility of repurposing these drugs for SARS-CoV-2 VOCs, an essential step in responding to the evolving global pandemic. MDPI 2023-07-05 /pmc/articles/PMC10385313/ /pubmed/37514075 http://dx.doi.org/10.3390/pharmaceutics15071891 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
Mulgaonkar, Nirmitee
Wang, Haoqi
Zhang, Junrui
Roundy, Christopher M.
Tang, Wendy
Chaki, Sankar Prasad
Pauvolid-Corrêa, Alex
Hamer, Gabriel L.
Fernando, Sandun
Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title_full Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title_fullStr Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title_full_unstemmed Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title_short Montelukast and Telmisartan as Inhibitors of SARS-CoV-2 Omicron Variant
title_sort montelukast and telmisartan as inhibitors of sars-cov-2 omicron variant
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10385313/
https://www.ncbi.nlm.nih.gov/pubmed/37514075
http://dx.doi.org/10.3390/pharmaceutics15071891
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