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Prediction of Drug-Disease Relationship on Heterogeneous Networks Based on Graph Convolution

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Bioinformatics Research and Applications (ISBRA 2022)

Part of the book series: Lecture Notes in Computer Science ((LNBI,volume 13760))

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Abstract

Drug-disease association prediction is essential in drug development and repositioning. At present, the proposed drug-disease association prediction models based on graph convolution usually learn the characterization of the entire drug-disease heterogeneous network. However, the obtained characterization information come more from the characteristics of neighboring nodes in the homogeneous network, it lacks attribute information of nodes in the heterogeneous network, thus affecting the model's predictive performance. In this paper, an end-to-end model named DAHNGC based on graph convolutional neural networks is proposed to predict drug-disease association, which divides the characteristic learning of drugs and disease nodes into two parts. The proposed model uses the graph convolutional network to learn the attribute characteristics of drugs and disease nodes in the homogeneous network. Based on the known relationship between drugs and diseases, we design a method to automatically learn the characteristic information of drugs and disease nodes in heterogeneous networks. Subsequently, the drug-disease association matrix is reconstructed using a bilinear decoder to obtain a potential drug-disease association. In addition, we also adopt the DropEdge method to alleviate the over-smoothing problem of graph convolution. The experimental results show that the average AUC of the DAHNGC is 0.9113 through five-fold cross-verification, which is superior to that of the comparative method.

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References

  1. Paul, S.M., et al.: How to improve R&D productivity: the pharmaceutical industry’s grand challenge. Nat. Rev. Drug Discov. 9(3), 203–214 (2010)

    Article  CAS  PubMed  Google Scholar 

  2. Adams, C.P., Brantner, V.V.: Estimating the cost of new drug development: is it really $802 million? Health Aff. 25(2), 420–428 (2006)

    Article  Google Scholar 

  3. Li, J., Zheng, S., Chen, B., Butte, A.J., Swamidass, S.J., Lu, Z.: A survey of current trends in computational drug repositioning. Brief. Bioinform. 17(1), 2–12 (2016)

    Article  PubMed  Google Scholar 

  4. Ashburn, T.T., Thor, K.B.: Drug repositioning: identifying and developing new uses for existing drugs. Nat. Rev. Drug Discov. 3(8), 673–683 (2004)

    Article  CAS  PubMed  Google Scholar 

  5. Wang, W., Yang, S., Zhang, X., Li, J.: Drug repositioning by integrating target information through a heterogeneous network model. Bioinformatics 30(20), 2923–2930 (2014)

    Article  CAS  PubMed  PubMed Central  Google Scholar 

  6. Dai, W., et al.: Matrix factorization-based prediction of novel drug indications by integrating genomic space. Comput. Math. Methods Med. 2015 (2015)

    Google Scholar 

  7. Zhao, B.-W., You, Z.-H., Hu, L., Wong, L., Ji, B.-Y., Zhang, P.: A multi-graph deep learning model for predicting drug-disease associations. In: Huang, D.-S., Jo, K.-H., Li, J., Gribova, V., Premaratne, P. (eds.) ICIC 2021. LNCS (LNAI), vol. 12838, pp. 580–590. Springer, Cham (2021). https://doi.org/10.1007/978-3-030-84532-2_52

    Chapter  Google Scholar 

  8. Wang, B., Lyu, X., Qu, J., Sun, H., Pan, Z., Tang, Z.: GNDD: a graph neural network-based method for drug-disease association prediction. In: 2019 IEEE International Conference on Bioinformatics and Biomedicine (BIBM), pp. 1253–1255, November 2019

    Google Scholar 

  9. Yu, Z., Huang, F., Zhao, X., Xiao, W., Zhang, W.: Predicting drug–disease associations through layer attention graph convolutional network. Brief. Bioinform. 22(4), bbaa243 (2021)

    Google Scholar 

  10. Liu, Z., Chen, Q., Lan, W., Pan, H., Hao, X., Pan, S.: GADTI: graph autoencoder approach for DTI prediction from heterogeneous network. Front. Genet. 12, 650821 (2021)

    Article  PubMed  PubMed Central  Google Scholar 

  11. Wu, G., Liu, J.: Predicting drug-disease treatment associations based on topological similarity and singular value decomposition. In: 2019 IEEE International Conference on Bioinformatics and Biomedicine (BIBM), pp. 153–158, November 2019

    Google Scholar 

  12. Gottlieb, A., Stein, G.Y., Ruppin, E., Sharan, R.: PREDICT: a method for inferring novel drug indications with application to personalized medicine. Mol. Syst. Biol. 7(1), 496 (2011)

    Article  PubMed  PubMed Central  Google Scholar 

  13. Wishart, D.S., et al.: DrugBank 5.0: a major update to the DrugBank database for 2018. Nucleic Acids Res. 46(D1), D1074–D1082 (2018)

    Google Scholar 

  14. Hamosh, A., Scott, A.F., Amberger, J.S., Bocchini, C.A., McKusick, V.A.: Online mendelian inheritance in man (OMIM), a knowledge base of human genes and genetic disorders. Nucleic Acids Res. 33(suppl._1), D514–D517 (2005)

    Google Scholar 

  15. Li, J., Zhang, S., Liu, T., Ning, C., Zhang, Z., Zhou, W.: Neural inductive matrix completion with graph convolutional networks for miRNA-disease association prediction. Bioinformatics 36(8), 2538–2546 (2020)

    Article  CAS  PubMed  Google Scholar 

  16. Huang, W., Rong, Y., Xu, T., Sun, F., Huang, J.: Tackling over-smoothing for general graph convolutional networks. arXiv preprint arXiv: 2008.09864 (2020)

  17. Rong, Y., Huang, W., Xu, T., Huang, J.: Dropedge: Towards deep graph convolutional networks on node classification. arXiv preprint arXiv: arXiv:1907.10903 (2019)

  18. Wan, F., Hong, L., Xiao, A., Jiang, T., Zeng, J.: NeoDTI: neural integration of neighbor information from a heterogeneous network for discovering new drug–target interactions. Bioinformatics 35(1), 104–111 (2019)

    Article  CAS  PubMed  Google Scholar 

  19. Zhang, W., et al.: Predicting drug-disease associations by using similarity constrained matrix factorization. BMC Bioinformatics 19(1), 1–12 (2018)

    Article  Google Scholar 

  20. Li, X.X., et al.: Adrenergic and endothelin B receptor-dependent hypertension in dopamine receptor type-2 knockout mice. Hypertension 38(3), 303–308 (2001)

    Article  CAS  PubMed  Google Scholar 

  21. Buemi, M., et al.: Reduced bcl-2 concentrations in hypertensive patients after lisinopril or nifedipine administration. Am. J. Hypertens. 12(1), 73–75 (1999)

    Article  CAS  PubMed  Google Scholar 

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Acknowledgment

This work was supported by the China Scholarship Council (201906725017), the Collaborative Education Project of Industry University cooperation of the Chinese Ministry of Education (201902098015), the Teaching Reform Project of Hunan Normal University (82).

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Correspondence to Qiu Xiao .

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Zhong, J., Cui, P., Qu, Z., Wang, L., Xiao, Q., Zhu, Y. (2022). Prediction of Drug-Disease Relationship on Heterogeneous Networks Based on Graph Convolution. In: Bansal, M.S., Cai, Z., Mangul, S. (eds) Bioinformatics Research and Applications. ISBRA 2022. Lecture Notes in Computer Science(), vol 13760. Springer, Cham. https://doi.org/10.1007/978-3-031-23198-8_22

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  • DOI: https://doi.org/10.1007/978-3-031-23198-8_22

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  • Online ISBN: 978-3-031-23198-8

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