Table 2 Reconstruction of ChEMBL compound-target pairs at different thresholds
BM conserv. | Compound proportion | |||||
|---|---|---|---|---|---|---|
0.5 | 0.6 | 0.7 | 0.8 | 0.9 | 1.0 | |
0.5 | 7686 | 1737 | 202 | 48 | 34 | 34 |
0.6 | 5344 | 991 | 83 | 11 | 10 | 10 |
0.7 | 3844 | 651 | 49 | 7 | 6 | 6 |
0.8 | 2531 | 353 | 24 | 2 | 1 | 1 |
0.9 | 2100 | 279 | 20 | 1 | 0 | 0 |
1.0 | 2028 | 271 | 19 | 1 | 0 | 0 |