Lead ID / ADMET
33 benchmark(s) tagged with this stage. ← All stages
| Name | Modalities | Validation | Score | Flags |
|---|---|---|---|---|
| TDC ADMET Group | small-molecule | Retrospective | 100.0 | |
| SAbDab | biologic-mab | Retrospective | 100.0 | |
| ChEMBL | small-moleculeprotein-general | Wet-lab confirmed | 97.5 | |
| Observed Antibody Space (OAS) | biologic-mab | Retrospective | 97.5 | |
| ProteinGym | protein-general | Wet-lab confirmed | 97.5 | |
| Therapeutic Antibody Design Benchmark 2026 | biologic | Wet-lab confirmed | 97.0 | |
| RxRx3 Phenomics Benchmark | small-molecule | Wet-lab confirmed | 94.9 | |
| ASAP Discovery Antiviral 2025 | small-molecule | Prospective | 93.9 | |
| Practical Molecular Optimization (PMO) | small-molecule | Retrospective | 88.9 | |
| Polaris ADMET | small-molecule | Prospective | 88.4 | |
| Cell Line Sensitivity Benchmark (CLSB) | small-molecule | Wet-lab confirmed | 88.1 | |
| ISM Benchmarks: GPCRs (Insilico) | small-moleculeprotein-general | Retrospective | 87.6 | |
| ToxCast | small-molecule | Retrospective | 85.6 | |
| GNNBench-Drug 2026 | small-molecule | Retrospective | 85.6 | |
| ISM Benchmarks: ADMET (Insilico) | small-molecule | Wet-lab confirmed | 84.6 | |
| Longevity Compound Benchmark | small-molecule | Wet-lab confirmed | 84.6 | |
| MoleculeACE | small-molecule | Retrospective | 83.3 | |
| DrugComb 2.0 Synergy Benchmark | small-molecule | Retrospective | 83.0 | |
| DMPK Integrated Benchmark | small-molecule | Retrospective | 82.5 | |
| mRNA Design Benchmark (CodonBench 2026) | rna-therapeutic | Prospective | 82.0 | |
| GuacaMol | small-molecule | Retrospective | 80.5 | |
| ADMET-AI | small-molecule | Retrospective | 79.5 | |
| AMES (mutagenicity) | small-molecule | Retrospective | 79.5 | |
| MoleculeNet | small-molecule | Retrospective | 78.0 | data-leakage-known |
| USPTO-50K / USPTO-MIT (Retrosynthesis) | small-molecule | Retrospective | 78.0 | data-leakage-known |
| Tox21 | small-molecule | Retrospective | 77.5 | |
| TDC DrugSyn (OncoPolyPharm + DrugComb_NCI60) | small-molecule | Wet-lab confirmed | 77.0 | |
| Obach PK Dataset | small-molecule | Retrospective | 77.0 | |
| PDBbind | small-moleculeprotein-general | Retrospective | 75.9 | data-leakage-known |
| hERG (cardio-tox) TDC | small-molecule | Retrospective | 73.9 | |
| DILI / LD50 Zhu | small-molecule | Retrospective | 73.9 | |
| MOSES | small-molecule | Retrospective | 72.4 | |
| ClinTox | small-molecule | Retrospective | 65.6 | data-leakage-known |