ProTox 3.0
Charité Berlin
Comprehensive toxicity prediction with 61 models across acute toxicity, organ toxicity, mutagenicity, carcinogenicity, and toxicological pathway activity.
Best For
Comprehensive toxicity panel; organ toxicity + AOP mapping
License
Free web server
Strengths
- +61 models
- +AOP/MIE mapping
- +Cross-validation 80-99% accuracy
Limitations
- −No structural alert visualization
- −Self-reported performance metrics
R&D Pipeline Coverage
Related Tools
ADMET-AI
Greenstone Biosciences / Stanford
Predicts 41 ADMET endpoints using a Chemprop-RDKit GNN. Held the highest average rank on the TDC ADMET Leaderboard at time of publication.
ADMETlab 3.0
SCBDD Group, Central South University
Comprehensive ADMET prediction platform covering 119 endpoints with uncertainty estimates. Trained on >400,000 curated entries.
More in ADMET Prediction
ADMET-AI
Greenstone Biosciences / Stanford
Predicts 41 ADMET endpoints using a Chemprop-RDKit GNN. Held the highest average rank on the TDC ADMET Leaderboard at time of publication.
ADMETlab 3.0
SCBDD Group, Central South University
Comprehensive ADMET prediction platform covering 119 endpoints with uncertainty estimates. Trained on >400,000 curated entries.
SwissADME
Swiss Institute of Bioinformatics (SIB)
Predicts pharmacokinetics, drug-likeness, and medicinal chemistry friendliness. Known for the BOILED-Egg visualization and Bioavailability Radar.
Stay updated on ProTox 3.0
Weekly newsletter covering AI tool releases, benchmarks, and what practitioners actually use.