Table 2. Performance on the Validation Set with a Threshold of 5 or 7 in pXC50a.
| dataset | threshold | MCC | recall | precision |
|---|---|---|---|---|
| BACE1 | 5 | 0.77 | 0.92 | 0.84 |
| 7 | 0.55 | 0.61 | 0.87 | |
| CCR5 | 5 | 0.83 | 0.93 | 0.91 |
| 7 | 0.61 | 0.83 | 0.75 | |
| DRD2 | 5 | 0.78 | 0.94 | 0.84 |
| 7 | 0.56 | 0.90 | 0.59 | |
| EGFR | 5 | 0.67 | 0.82 | 0.86 |
| 7 | 0.38 | 0.48 | 0.79 | |
| NR1H2 | 5 | 0.74 | 0.89 | 0.84 |
| 7 | 0.43 | 0.79 | 0.54 |
The numbers are the mean values from the last five epochs.