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. 2019 Jun 4;24(11):2115. doi: 10.3390/molecules24112115

Table 7.

Performance statistics for failed PNNs generated with the specified error in each split.

Model %Error Failure 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 PNN Control 0.782 34.7 4200 19,000 550
Split 1 Error 20 0.654 726 4200 12,000 17
Split 2 Error 30 0.615 287 3300 7600 26
Split 3 Error 15 0.635 1200 4100 3300 2.8