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. 2019 Sep 9;5(9):e02446. doi: 10.1016/j.heliyon.2019.e02446

Table 5.

Toxicity predicted of the 11 studied compounds in comparison with the reference drug.

ID Ref M1 M2 M3 M4 M5 M6 M7 M8 M9 M10 M11
algae_at 0.008 0.019 0.013 0.011 0.053 0.064 0.055 0.040 0.037 0.076 0.025 0.011
Ames_test Mutagen Mutagen Non-mutagen Mutagen Mutagen Mutagen Mutagen Mutagen Mutagen Mutagen Mutagen Mutagen
Carcino_Mouse Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative
Carcino_Rat Positive Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative
daphnia_at 0.030 0.024 0.022 0.009 0.0434 0.044 0.078 0.070 0.029 0.059 0.020 0.012
hERG_inhibition Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk Medium_risk
TA100_10RLI Negative Negative Negative Negative Positive Positive Positive Positive Positive Positive Negative Negative
TA100_NA Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative
TA1535_10RLI Positive Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative
TA1535_NA Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative Negative