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AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs

Antioxidant proteins can not only balance the oxidative stress in the body, but are also an important component of antioxidant drugs. Accurate identification of antioxidant proteins is essential to help humans fight diseases and develop new drugs. In this paper, we developed a friendly method AOPM t...

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Autores principales: Zhai, Yixiao, Zhang, Jingyu, Zhang, Tianjiao, Gong, Yue, Zhang, Zixiao, Zhang, Dandan, Zhao, Yuming
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8803896/
https://www.ncbi.nlm.nih.gov/pubmed/35115948
http://dx.doi.org/10.3389/fphar.2021.818115
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author Zhai, Yixiao
Zhang, Jingyu
Zhang, Tianjiao
Gong, Yue
Zhang, Zixiao
Zhang, Dandan
Zhao, Yuming
author_facet Zhai, Yixiao
Zhang, Jingyu
Zhang, Tianjiao
Gong, Yue
Zhang, Zixiao
Zhang, Dandan
Zhao, Yuming
author_sort Zhai, Yixiao
collection PubMed
description Antioxidant proteins can not only balance the oxidative stress in the body, but are also an important component of antioxidant drugs. Accurate identification of antioxidant proteins is essential to help humans fight diseases and develop new drugs. In this paper, we developed a friendly method AOPM to identify antioxidant proteins. 188D and the Composition of k-spaced Amino Acid Pairs were adopted as the feature extraction method. In addition, the Max-Relevance-Max-Distance algorithm (MRMD) and random forest were the feature selection and classifier, respectively. We used 5-folds cross-validation and independent test dataset to evaluate our model. On the test dataset, AOPM presented a higher performance compared with the state-of-the-art methods. The sensitivity, specificity, accuracy, Matthew’s Correlation Coefficient and an Area Under the Curve reached 87.3, 94.2, 92.0%, 0.815 and 0.972, respectively. In addition, AOPM still has excellent performance in predicting the catalytic enzymes of antioxidant drugs. This work proved the feasibility of virtual drug screening based on sequence information and provided new ideas and solutions for drug development.
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spelling pubmed-88038962022-02-02 AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs Zhai, Yixiao Zhang, Jingyu Zhang, Tianjiao Gong, Yue Zhang, Zixiao Zhang, Dandan Zhao, Yuming Front Pharmacol Pharmacology Antioxidant proteins can not only balance the oxidative stress in the body, but are also an important component of antioxidant drugs. Accurate identification of antioxidant proteins is essential to help humans fight diseases and develop new drugs. In this paper, we developed a friendly method AOPM to identify antioxidant proteins. 188D and the Composition of k-spaced Amino Acid Pairs were adopted as the feature extraction method. In addition, the Max-Relevance-Max-Distance algorithm (MRMD) and random forest were the feature selection and classifier, respectively. We used 5-folds cross-validation and independent test dataset to evaluate our model. On the test dataset, AOPM presented a higher performance compared with the state-of-the-art methods. The sensitivity, specificity, accuracy, Matthew’s Correlation Coefficient and an Area Under the Curve reached 87.3, 94.2, 92.0%, 0.815 and 0.972, respectively. In addition, AOPM still has excellent performance in predicting the catalytic enzymes of antioxidant drugs. This work proved the feasibility of virtual drug screening based on sequence information and provided new ideas and solutions for drug development. Frontiers Media S.A. 2022-01-18 /pmc/articles/PMC8803896/ /pubmed/35115948 http://dx.doi.org/10.3389/fphar.2021.818115 Text en Copyright © 2022 Zhai, Zhang, Zhang, Gong, Zhang, Zhang and Zhao. https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms.
spellingShingle Pharmacology
Zhai, Yixiao
Zhang, Jingyu
Zhang, Tianjiao
Gong, Yue
Zhang, Zixiao
Zhang, Dandan
Zhao, Yuming
AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title_full AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title_fullStr AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title_full_unstemmed AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title_short AOPM: Application of Antioxidant Protein Classification Model in Predicting the Composition of Antioxidant Drugs
title_sort aopm: application of antioxidant protein classification model in predicting the composition of antioxidant drugs
topic Pharmacology
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8803896/
https://www.ncbi.nlm.nih.gov/pubmed/35115948
http://dx.doi.org/10.3389/fphar.2021.818115
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