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Bibliographic Details
Main Author: Chavan, Swapnil
Format: Recurso digital
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Published: Zenodo 2026
Online Access:https://doi.org/10.5281/zenodo.20272071
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Table of Contents:
  • <div>This dataset is derived from PubChem BioAssay AID 743067, titled "qHTS assay to identify small molecule antagonists of the thyroid receptor (TR) signaling pathway".</div> <div> </div> <div> <div>The original assay is part of the Tox21 program and evaluates inhibition of thyroid receptor (TR) signaling using a reporter gene assay in a cell-based system. TR activity was measured using a luciferase reporter controlled by thyroid hormone response elements.</div> <div> </div> <div> <div>Original dataset statistics:</div> <div>- Tested compounds: 8,099 - Active (antagonists): 378 - Inactive: 5,631</div> <div> </div> <div> <div>Data preprocessing:</div> <div>- Removed duplicate entries based on compound identifiers. - Resolved conflicting labels by excluding compounds with inconsistent activity annotations.</div> </div> <div> </div> <div> <div>Final cleaned dataset:</div> <div>- Total compounds: 5,590 - Positive (antagonists): 261 - Negative (inactive): 5,329</div> <div> </div> </div> </div> </div>