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An in silico drug repositioning workflow for host-based antivirals

Drug repositioning represents a cost- and time-efficient strategy for drug development. Artificial intelligence-based algorithms have been applied in drug repositioning by predicting drug-target interactions in an efficient and high throughput manner. Here, we present a workflow of in silico drug re...

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Detalles Bibliográficos
Autores principales: Li, Zexu, Yao, Yingjia, Cheng, Xiaolong, Li, Wei, Fei, Teng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8273420/
https://www.ncbi.nlm.nih.gov/pubmed/34286288
http://dx.doi.org/10.1016/j.xpro.2021.100653
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author Li, Zexu
Yao, Yingjia
Cheng, Xiaolong
Li, Wei
Fei, Teng
author_facet Li, Zexu
Yao, Yingjia
Cheng, Xiaolong
Li, Wei
Fei, Teng
author_sort Li, Zexu
collection PubMed
description Drug repositioning represents a cost- and time-efficient strategy for drug development. Artificial intelligence-based algorithms have been applied in drug repositioning by predicting drug-target interactions in an efficient and high throughput manner. Here, we present a workflow of in silico drug repositioning for host-based antivirals using specially defined targets, a refined list of drug candidates, and an easily implemented computational framework. The workflow described here can also apply to more general purposes, especially when given a user-defined druggable target gene set. For complete details on the use and execution of this protocol, please refer to Li et al. (2021).
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spelling pubmed-82734202021-07-19 An in silico drug repositioning workflow for host-based antivirals Li, Zexu Yao, Yingjia Cheng, Xiaolong Li, Wei Fei, Teng STAR Protoc Protocol Drug repositioning represents a cost- and time-efficient strategy for drug development. Artificial intelligence-based algorithms have been applied in drug repositioning by predicting drug-target interactions in an efficient and high throughput manner. Here, we present a workflow of in silico drug repositioning for host-based antivirals using specially defined targets, a refined list of drug candidates, and an easily implemented computational framework. The workflow described here can also apply to more general purposes, especially when given a user-defined druggable target gene set. For complete details on the use and execution of this protocol, please refer to Li et al. (2021). Elsevier 2021-07-07 /pmc/articles/PMC8273420/ /pubmed/34286288 http://dx.doi.org/10.1016/j.xpro.2021.100653 Text en © 2021 The Author(s) https://creativecommons.org/licenses/by-nc-nd/4.0/This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Protocol
Li, Zexu
Yao, Yingjia
Cheng, Xiaolong
Li, Wei
Fei, Teng
An in silico drug repositioning workflow for host-based antivirals
title An in silico drug repositioning workflow for host-based antivirals
title_full An in silico drug repositioning workflow for host-based antivirals
title_fullStr An in silico drug repositioning workflow for host-based antivirals
title_full_unstemmed An in silico drug repositioning workflow for host-based antivirals
title_short An in silico drug repositioning workflow for host-based antivirals
title_sort in silico drug repositioning workflow for host-based antivirals
topic Protocol
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8273420/
https://www.ncbi.nlm.nih.gov/pubmed/34286288
http://dx.doi.org/10.1016/j.xpro.2021.100653
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