scikit-fingerprints/TDC_pgp_broccatelli
TDC P-gp Inhibition P-gp (P-glycoprotein) Inhibition dataset [1], part of TDC [2] benchmark. It is intended to be used through scikit-fingerprints library. The task is to predict whether a molecule inhibits the P-glycoprotein. P-glycoprotein (P-gp) is an ABC transporter protein involved in intestinal absorption, drug metabolism, and brain penetration, and its inhibition can seriously alter a drug's bioavailability and safety Characteristic Description Tasks 1 Task… See the full description on the dataset page: https://huggingface.co/datasets/scikit-fingerprints/TDC_pgp_broccatelli.
| Author / organization | scikit-fingerprints |
|---|---|
| License (as declared) | unknown |
| Downloads | 381 (as reported by Hugging Face) |
| Likes | 0 |
| Created | 16 February 2025 |
| Last updated at source | 22 June 2025 |
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- 17 Oct 2026 Description: TDC P-gp Inhibition P-gp (P-glycoprotein) Inhibition dataset [1], part of TDC [2] benchmark. It is intended to be used through scikit-fingerprints library. The task is to predict whether a molecule inhibits the P-glycoprotein. P-glycoprotei → TDC P-gp Inhibition P-gp (P-glycoprotein) Inhibition dataset [1], part of TDC [2] benchmark. It is intended to be used through scikit-fingerprints library. The task is to predict whether a molecule inhibits the P-glycoprotein. P-glycoprotei
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