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Table 3 The accuracy values of the substrate models based on the 10 randomly-generated negative datasets

From: Machine learning to predict metabolic drug interactions related to cytochrome P450 isozymes

  Des 1A2_Sub 2C9_Sub 2C19_Sub 2D6_Sub 3A4_Sub
1 2D 0.70 ± 0.049 0.72 ± 0.042 0.74 ± 0.045 0.78 ± 0.031 0.75 ± 0.025
2 2D 0.69 ± 0.041 0.74 ± 0.041 0.73 ± 0.050 0.78 ± 0.028 0.77 ± 0.024
3 2D 0.71 ± 0.045 0.73 ± 0.041 0.75 ± 0.045 0.78 ± 0.031 0.76 ± 0.023
4 2D 0.69 ± 0.045 0.72 ± 0.048 0.75 ± 0.046 0.78 ± 0.031 0.74 ± 0.020
5 2D 0.72 ± 0.047 0.76 ± 0.035 0.74 ± 0.047 0.77 ± 0.033 0.76 ± 0.019
6 2D 0.72 ± 0.042 0.71 ± 0.045 0.74 ± 0.049 0.78 ± 0.035 0.75 ± 0.023
7 2D 0.71 ± 0.036 0.74 ± 0.040 0.75 ± 0.045 0.78 ± 0.031 0.75 ± 0.024
8 2D 0.72 ± 0.050 0.73 ± 0.046 0.74 ± 0.051 0.77 ± 0.033 0.75 ± 0.020
9 2D 0.72 ± 0.041 0.73 ± 0.042 0.77 ± 0.040 0.79 ± 0.032 0.75 ± 0.022
10 2D 0.71 ± 0.046 0.72 ± 0.045 0.73 ± 0.043 0.78 ± 0.034 0.74 ± 0.020
  1. Bold value represents the accuracy of the best of the 10 randomly generated negative sets