Table 1. Composition of the dataset.
CYP isoform | Tested compounds | Activecompounds | Active only against this CYP | Active also against: | ||||
1A2 | 2C9 | 2C19 | 2D6 | 3A4 | ||||
1A2 | 12 634 | 5 838 (46%) | 1 395 | 2 011 | 3 252 | 1 272 | 2 565 | |
2C9 | 12 264 | 4 024 (33%) | 370 | 2 011 | 3 022 | 800 | 2 115 | |
2C19 | 12 834 | 5 763 (45%) | 562 | 3 252 | 3 022 | 1 363 | 3 012 | |
2D6 | 13 276 | 2 545 (19%) | 622 | 1 272 | 800 | 1 363 | 1 252 | |
3A4 | 12 383 | 5 165 (42%) | 889 | 2 565 | 2 115 | 3 012 | 1 252 |