TABLE 2. Summary of Experimental Datasets.
| Data Sets | No. Comps | No. Proteins | No. Inters | Split | No. samples |
|---|---|---|---|---|---|
| DAVIS | 68 | 422 | 30,056 | Train | 20,037 |
| Validation | 5,009 | ||||
| Test | 5,010 | ||||
| KIBA | 2111 | 229 | 118,254 | Train | 78,836 |
| Validation | 19,709 | ||||
| Test | 19,709 |
Comps= (compounds), Inter=(interactions)