Automated design and optimization of multitarget schizophrenia drug candidates by deep learning
Xiaoqin Tan, Xiangrui Jiang, He Yang, Feisheng Zhong, Xutong Li, Zhaoping Xiong, Zhaojun Li, Xiaohong Liu, Cui Chen, Qingjie Zhao, Yuanchao Xie, Feipu Yang, Chunhui Wu, Jingshan Shen, Mingyue Zheng, , Hualiang Jiang
This paper develops a deep learning system to design multitarget antipsychotic drugs, generating novel compounds with activity against multiple receptors and demonstrating efficacy in animal models.
European Journal of Medicinal Chemistry · Jul 11, 2020Peer-reviewedBioinformatics