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Table 9 Comparison of the observed and predicted by SHAFTS for several similarity thresholds

From: Maximum common property: a new approach for molecular similarity

Threshold

Real-predicted

Pairs

%

Predicted

Pairs

%

0.90

Active-active

19

24

Correct

31

42

Inactive-inactive

13

18

Active-inactive

18

24

Incorrect

43

58

Inactive-active

25

34

Total

74

100

Total

74

100

0.80

Active-active

75

29

Correct

137

53

Inactive-inactive

62

24

Active-inactive

43

17

Incorrect

120

47

Inactive-active

77

30

Total

257

100

Total

257

100

0.70

Active-active

107

22

Correct

224

45

Inactive-inactive

117

24

Active-inactive

76

15

Incorrect

271

55

Inactive-active

195

39

Total

495

100

Total

495

100

  1. Pairs-Number of predicted pairs