| Task Name | Dataset Name | SOTA Result | Trend | |
|---|---|---|---|---|
| Graph property prediction | BACE | ROC AUC98.4 | 93 | |
| Molecular property prediction | BACE (test) | ROC-AUC89.4 | 65 | |
| Molecular property prediction | BACE | ROC-AUC89.7 | 35 | |
| Molecular property classification | BACE (MoleculeNet) scaffold (test) | ROC-AUC0.894 | 30 | |
| Graph-level molecular classification | BACE | MCC0.721 | 18 | |
| Molecular property prediction | BACE 50-shot (test) | ROC-AUC0.6756 | 15 | |
| Molecular prediction | BACE 100-shot (test) | ROC-AUC0.6176 | 15 | |
| Graph-level molecular classification | BACE | Accuracy85.8 | 10 | |
| Multi-label Binary Classification | Bace MoleculeNet (test) | AUC87.4 | 10 | |
| Pruning | BACE (test) | AU-MSE1.61 | 8 | |
| Activation Task | BACE | AUAC70.7 | 8 | |
| GNN Explanation | BACE | H-Fidelity0.5934 | 6 | |
| Graph Classification | BACE (test) | MCC0.721 | 4 |