Table 1 Summary of the benchmark datasets
From: SubMDTA: drug target affinity prediction based on substructure extraction and multi-scale features
Dataset | Proteins | Compounds | Interactions | Train | Test |
|---|---|---|---|---|---|
Davis | 442 | 68 | 30,056 | 25,046 | 5010 |
KIBA | 229 | 2111 | 118,254 | 98,545 | 19,709 |