Using informative features in machine learning based method for COVID-19 drug repurposing

被引:18
|
作者
Aghdam, Rosa [1 ]
Habibi, Mahnaz [2 ]
Taheri, Golnaz [3 ,4 ]
机构
[1] Inst Res Fundamental Sci IPM, Sch Biol Sci, Tehran, Iran
[2] Islamic Azad Univ, Dept Math, Qazvin Branch, Qazvin, Iran
[3] KTH Royal Inst Technol, Dept Elect Engn & Comp Sci, Stockholm, Sweden
[4] Sci Life Lab, Stockholm, Sweden
关键词
Coronavirus disease 2019; SARS-CoV-2; Protein-protein interaction; Clustering method;
D O I
10.1186/s13321-021-00553-9
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Coronavirus disease 2019 (COVID-19) is caused by a novel virus named Severe Acute Respiratory Syndrome Coronavirus-2 (SARS-CoV-2). This virus induced a large number of deaths and millions of confirmed cases worldwide, creating a serious danger to public health. However, there are no specific therapies or drugs available for COVID-19 treatment. While new drug discovery is a long process, repurposing available drugs for COVID-19 can help recognize treatments with known clinical profiles. Computational drug repurposing methods can reduce the cost, time, and risk of drug toxicity. In this work, we build a graph as a COVID-19 related biological network. This network is related to virus targets or their associated biological processes. We select essential proteins in the constructed biological network that lead to a major disruption in the network. Our method from these essential proteins chooses 93 proteins related to COVID-19 pathology. Then, we propose multiple informative features based on drug-target and protein-protein interaction information. Through these informative features, we find five appropriate clusters of drugs that contain some candidates as potential COVID-19 treatments. To evaluate our results, we provide statistical and clinical evidence for our candidate drugs. From our proposed candidate drugs, 80% of them were studied in other studies and clinical trials.
引用
收藏
页数:14
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