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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Elsevier
2021
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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). |
format | Online Article Text |
id | pubmed-8273420 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | Elsevier |
record_format | MEDLINE/PubMed |
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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