DeepCYP

A freely accessible deep-learning web server for end-to-end CYP450 metabolic profiling.

Highlights

  • Covers nine major CYP isoforms in a unified pathway–site–product pipeline.
  • Multi-task graph neural network with multi-scale descriptors, operating directly on 2D molecular graphs.
  • Supports high-throughput batch processing for early metabolic-liability assessment.

Links: Paper · Server