Deep-PK
BioSig Lab (University of Queensland)
Deep learning successor to pkCSM. Predicts 73 endpoints using GNNs with molecular optimization and interpretability outputs.
Best For
Modern replacement for pkCSM with broader coverage
License
Free web server
Strengths
- +73 endpoints
- +GNN architecture
- +Interpretability outputs
Limitations
- −Relatively new (2024)
- −Limited independent validation
R&D Pipeline Coverage
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Predicts 28 PK and toxicity properties using graph-based molecular signatures. Long-standing academic reference tool.
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ADMETlab 3.0
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Comprehensive ADMET prediction platform covering 119 endpoints with uncertainty estimates. Trained on >400,000 curated entries.
SwissADME
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Predicts pharmacokinetics, drug-likeness, and medicinal chemistry friendliness. Known for the BOILED-Egg visualization and Bioavailability Radar.
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