DRONet: effectiveness-driven drug repositioning framework using network embedding and ranking learning

被引:10
作者
Yang, Kuo [1 ]
Yang, Yuxia [1 ]
Fan, Shuyue [1 ]
Xia, Jianan [1 ]
Zheng, Qiguang [1 ]
Dong, Xin [1 ]
Liu, Jun
Liu, Qiong
Lei, Lei
Zhang, Yingying [2 ]
Li, Bing [3 ]
Gao, Zhuye [4 ]
Zhang, Runshun [5 ]
Liu, Baoyan [6 ]
Wang, Zhong
Zhou, Xuezhong [1 ]
机构
[1] Beijing Jiaotong Univ, Sch Comp & Informat Technol, Beijing Key Lab Traff Data Anal & Min, Inst Med Intelligence, Beijing, Peoples R China
[2] Beijing Univ Chinese Med, Dongzhimen Hosp, Beijing, Peoples R China
[3] China Acad Chinese Med Sci, Inst Chinese Materia Med, Beijing, Peoples R China
[4] China Acad Chinese Med Sci, Natl Clin Res Ctr Chinese Med Cardiol, Xiyuan Hosp, Beijing, Peoples R China
[5] China Acad Chinese Med Sci, Guanganmen Hosp, Beijing, Peoples R China
[6] China Acad Chinese Med Sci, Data Ctr Tradit Chinese Med, Beijing, Peoples R China
基金
中国国家自然科学基金; 国家重点研发计划;
关键词
Drug repositioning; Drug effectiveness; network embedding; learn to rank; DISEASE; REPRESENTATION;
D O I
10.1093/bib/bbac518
中图分类号
Q5 [生物化学];
学科分类号
071010 ; 081704 ;
摘要
As one of the most vital methods in drug development, drug repositioning emphasizes further analysis and research of approved drugs based on the existing large amount of clinical and experimental data to identify new indications of drugs. However, the existing drug repositioning methods didn't achieve enough prediction performance, and these methods do not consider the effectiveness information of drugs, which make it difficult to obtain reliable and valuable results. In this study, we proposed a drug repositioning framework termed DRONet, which make full use of effectiveness comparative relationships (ECR) among drugs as prior information by combining network embedding and ranking learning. We utilized network embedding methods to learn the deep features of drugs from a heterogeneous drug -disease network, and constructed a high -quality drug -indication data set including effectiveness -based drug contrast relationships. The embedding features and ECR of drugs are combined effectively through a designed ranking learning model to prioritize candidate drugs. Comprehensive experiments show that DRONet has higher prediction accuracy (improving 87.4% on Hit@1 and 37.9% on mean reciprocal rank) than state of the art. The case analysis also demonstrates high reliability of predicted results, which has potential to guide clinical drug development.
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页数:12
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