Tianbiao Yang

TransformerCPI: improving compound–protein interaction prediction by sequence-based deep learning with self-attention mechanism and label reversal experiments

Lifan Chen, Xiaoqin Tan, Dingyan Wang et al. · Bioinformatics · 2020 · 515 citations · Full text

Sequence-based drug design as a concept in computational drug design

Lifan Chen, Zisheng Fan, Jie Chang et al. · Nature Communications · 2023 · 107 citations · Full text

Drug Target, Engineering, Molecular Biology +21

Deep Learning Enhancing Kinome-Wide Polypharmacology Profiling: Model Construction and Experiment Validation

Xutong Li, Zhaojun Li, Xiaolong Wu et al. · Journal of Medicinal Chemistry · 2019 · 102 citations

Discovery of Pyrazolo[3,4- <i>d</i> ]pyridazinone Derivatives as Selective DDR1 Inhibitors via Deep Learning Based Design, Synthesis, and Biological Evaluation

Xiaoqin Tan, Chunpu Li, Ruirui Yang et al. · Journal of Medicinal Chemistry · 2021 · 63 citations · Full text

DrugSpaceX: a large screenable and synthetically tractable database extending drug space

Tianbiao Yang, Zhaojun Li, Yingjia Chen et al. · Nucleic Acids Research · 2020 · 48 citations · Full text

Drug Target, Engineering, Hit Identification +25