#cyp450

Yiling Zhou, Sen Yang, Xiaoli Wang, Yuanhang He, Yao Tian, Jiacai Yi, Yikun Wang, Youchao Deng, Dejun Jiang, Dongsheng Cao

DeepCYP is an integrated deep learning web server for holistic prediction of CYP450-mediated metabolism, jointly inferring the metabolic pathway, the site of metabolism, and the resulting product within a single platform…

Yiling Zhou, Dejun Jiang, Xiao Wei, Jiacai Yi, Yikun Wang, Youchao Deng, Dongsheng Cao

DeepMetab is the first comprehensive, mechanistically informed deep graph learning framework for end-to-end prediction of CYP450-mediated drug metabolism, unifying substrate profiling, site-of-metabolism localization, and metabolite generation in a single multi-task architecture…

A freely accessible deep-learning web server for end-to-end CYP450 metabolic profiling, covering the pathway–site–product continuum across nine major isoforms.