Dataset | Model | CI | MSE | R | \(r_m^2\) | AUPR |
---|---|---|---|---|---|---|
Original Davis Dataset | KronRLS | 0.871 | 0.379 | – | 0.407 | 0.661 |
SimBoost | 0.872 | 0.282 | – | 0.644 | 0.709 | |
DeepDTA | 0.876 (0.004) | 0.261 | 0.846 | 0.630 (0.017) | 0.714 (0.010) | |
WideDTA | 0.886 | 0.262 | – | – | – | |
DeepCDA | 0.891 (0.003) | 0.248 | 0.857 | 0.649 (0.009) | 0.739 (0.006) | |
ELECTRA-DTA | 0.897 (0.003) | 0.238 | 0.844 | 0.671 (0.032) | 0.698 (0.010) | |
refined Davis Dataset | DeepDTA | 0.882 (0.016) | 0.191 | 0.843 | 0.690 (0.035) | 0.695 (0.03) |
Attention-DTA | 0.888 (0.007) | 0.195 | 0.836 | 0.697 (0.005) | 0.677 (0.022) | |
ELECTRA-DTA | 0.896 (0.002) | 0.195 | 0.838 | 0.637 (0.048) | 0.685 (0.026) |