Drug-CoV: a drug-origin knowledge graph discovering drug repurposing targeting COVID-19

被引:4
|
作者
Li, Sirui [1 ]
Wong, Kok Wai [1 ]
Zhu, Dengya [2 ]
Fung, Chun Che [1 ]
机构
[1] Murdoch Univ, Sch Informat Technol, South St, Murdoch, WA, Australia
[2] Curtin Univ, Sch Management & Mkt, Discipline Business Informat Syst, Kent St, Bentley, WA, Australia
关键词
Drug repurposing; Graph-based representation; COVID-19; Knowledge graph;
D O I
10.1007/s10115-023-01923-5
中图分类号
TP18 [人工智能理论];
学科分类号
081104 ; 0812 ; 0835 ; 1405 ;
摘要
Drug repurposing is a technique for probing new usages of existing medicines, but its traditional methods, such as computational approaches, can be time-consuming and laborious. Recently, knowledge graphs (KGs) have emerged as a powerful approach for graph-based representation in drug repurposing, encoding entities and relations to predict new connections and facilitate drug discovery. As COVID-19 has become a major public health concern, it is critical to establish an appropriate COVID-19 KG for drug repurposing to combat the spread of the virus. However, most publicly available COVID-19 KGs lack support for multi-relations and comprehensive entity types. Moreover, none of them originates from COVID-19-related drugs, making it challenging to identify effective treatments. To tackle these issues, we developed Drug-CoV, a drug-origin and multi-relational COVID-19 KG. We evaluated the quality of Drug-CoV by performing link prediction and comparing the results to another publicly available COVID-19 KG. Our results showed that Drug-CoV outperformed the comparing KG in predicting new links between entities. Overall, Drug-CoV represents a valuable resource for COVID-19 drug repurposing efforts and demonstrates the potential of KGs for facilitating drug discovery.
引用
收藏
页码:5289 / 5308
页数:20
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