Predicting Drug-target Interaction via Wide and Deep Learning

被引:10
|
作者
Du, Yingyi [1 ]
Wang, Jihong [1 ]
Wang, Xiaodan [2 ]
Chen, Jiyun [1 ]
Chang, Huiyou [1 ]
机构
[1] Sun Yat Sen Univ, Sch Data & Comp Sci, Guangzhou, Guangdong, Peoples R China
[2] Guangdong Pharmaceut Univ, Sch Pharmaceut Chem & Chem Engn, Zhongshan, Peoples R China
关键词
drug-target interaction prediction; wide and deep model; machine learning; deep learning; DrugBank;
D O I
10.1145/3194480.3194491
中图分类号
Q [生物科学];
学科分类号
07 ; 0710 ; 09 ;
摘要
Identifying the interactions of approval drugs and targets is essential in medicine field, which can facilitate the discovery and reposition of drugs. Due to the tendency towards machine learning, a growing number of computational methods have been applied to the prediction of the drug-target interactions (DTIs). In this paper, we propose a wide and deep learning framework combining a generalized linear model and a deep feed-forward neural network to address the challenge of predicting the DTIs precisely. The proposed method is a joint training of the wide and deep models, which is implemented by feeding the weighted sum of the results obtained from the wide and deep models into a logistic loss function using mini-batch stochastic gradient descent. The results of this experiment indicate that the proposed method increases the accuracy of prediction for DTIs, which is superior to other methods.
引用
收藏
页码:128 / 132
页数:5
相关论文
共 50 条
  • [1] Predicting drug-target interaction network using deep learning model
    You, Jiaying
    McLeod, Robert D.
    Hu, Pingzhao
    COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 80 : 90 - 101
  • [2] Predicting Drug-Target Interaction Via Self-Supervised Learning
    Chen, Jiatao
    Zhang, Liang
    Cheng, Ke
    Jin, Bo
    Lu, Xinjiang
    Che, Chao
    IEEE-ACM TRANSACTIONS ON COMPUTATIONAL BIOLOGY AND BIOINFORMATICS, 2023, 20 (05) : 2781 - 2789
  • [3] Drug-target Interaction Prediction via Multiple Output Deep Learning
    Ye, Qing
    Zhang, Xiaolong
    Lin, Xiaoli
    2020 IEEE INTERNATIONAL CONFERENCE ON BIOINFORMATICS AND BIOMEDICINE, 2020, : 507 - 510
  • [4] Drug-target interaction prediction with deep learning
    YANG Shuo
    LI Shi-liang
    LI Hong-lin
    中国药理学与毒理学杂志, 2019, (10) : 855 - 855
  • [5] Predicting Drug-Target Interaction Using Deep Matrix Factorization
    Manoochehri, Hafez Eslami
    Nourani, Mehrdad
    2018 IEEE BIOMEDICAL CIRCUITS AND SYSTEMS CONFERENCE (BIOCAS): ADVANCED SYSTEMS FOR ENHANCING HUMAN HEALTH, 2018, : 551 - 554
  • [6] Deep-Learning-Based Drug-Target Interaction Prediction
    Wen, Ming
    Zhang, Zhimin
    Niu, Shaoyu
    Sha, Haozhi
    Yang, Ruihan
    Yun, Yonghuan
    Lu, Hongmei
    JOURNAL OF PROTEOME RESEARCH, 2017, 16 (04) : 1401 - 1409
  • [7] DeepPurpose: a deep learning library for drug-target interaction prediction
    Huang, Kexin
    Fu, Tianfan
    Glass, Lucas M.
    Zitnik, Marinka
    Xiao, Cao
    Sun, Jimeng
    BIOINFORMATICS, 2020, 36 (22-23) : 5545 - 5547
  • [8] Predicting drug-target interaction using positive-unlabeled learning
    Lan, Wei
    Wang, Jianxin
    Li, Min
    Liu, Jin
    Li, Yaohang
    Wu, Fang-Xiang
    Pan, Yi
    NEUROCOMPUTING, 2016, 206 : 50 - 57
  • [9] Predicting Drug-target Interactions via FM-DNN Learning
    Wang, Jihong
    Wang, Hao
    Wang, Xiaodan
    Chang, Huiyou
    CURRENT BIOINFORMATICS, 2020, 15 (01) : 68 - 76
  • [10] Drug-target interaction prediction with a deep-learning-based model
    Xie, Lingwei
    Zhang, Zhongnan
    He, Song
    Bo, Xiaochen
    Song, Xinyu
    2017 IEEE INTERNATIONAL CONFERENCE ON BIOINFORMATICS AND BIOMEDICINE (BIBM), 2017, : 469 - 476