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Composition of training and test set
| Transport Model | MRP4 | BSEP |
|---|---|---|
| Training set total (inhibitors/noninhibitors) | 57 (34/23) | 171 (43/128) |
| Test set total (inhibitors/noninhibitors) | 29 (17/12) | 86 (22/64) |
| Pharmacophore training subseta | 9 | 9 |
| Pharmacophore test setb | 77 | 247 |
Subset of drugs from the training set used to develop the pharmacophore.
Drugs not included in the pharmacophore training set were moved to the test set.
