openadmet/

cyp-challenge-train-test

A high-quality experimental dataset for predicting inhibition of the major drug-metabolizing Cytochrome P450 enzymes (CYP1A2, CYP2C9, CYP2D6, CYP3A4), released as part of the OpenADMET CYP Inhibition Blind Challenge. Blog post: Announcing OpenADMET’s CYP inhibition blind challenge Challenge Space: OpenADMET CYP Inhibition Blind Challenge Challenge period: August 17, 2026 - November 3, 2026 Produced by: OpenADMET

Updated… See the full description on the dataset page: https://huggingface.co/datasets/openadmet/cyp-challenge-train-test.