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Performance statistics for RFs with retained predictivity generated with 27% classification error in molecules between 109 nM and 3.7 nM.
| Model | ROC AUC | Top 10% Mean IC50 (nM) | Mean IC50 (nM) | Bottom 10% Mean IC50 (nM) | Fold Difference in Mean Top 10% IC50 |
|---|---|---|---|---|---|
| ALK < 20 nM RF | 0.913 | 3.33 | 4200 | 16,000 | 4800 |
| Split 1 Error | 0.911 | 4.87 | 4200 | 17,000 | 3500 |
| Split 2 Error | 0.920 | 15.6 | 3300 | 12,000 | 770 |
| Split 3 Error | 0.930 | 9.74 | 4100 | 12,000 | 1200 |
