AIMC Topic: Retinoid X Receptors

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An in silico to in vivo approach identifies retinoid-X receptor activating tert-butylphenols used in food contact materials.

Scientific reports Jul 18, 2025
The potential for food contact chemicals to disrupt genetic programs in development and metabolism raises concerns. Nuclear receptors (NRs) control many of these programs, and the retinoid-X receptor (RXR) is a DNA-binding partner for one-third of th...
Humans Machine Learning Computer Simulation Animals Protein Binding Signal Transduction Phenols Models, Molecular Xenopus laevis Retinoid X Receptors Receptors, Thyroid Hormone
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De Novo Design of Bioactive Small Molecules by Artificial Intelligence.

Molecular informatics Jan 10, 2018
Generative artificial intelligence offers a fresh view on molecular design. We present the first-time prospective application of a deep learning model for designing new druglike compounds with desired activities. For this purpose, we trained a recurr...
Humans Molecular Docking Simulation Drug Design Deep Learning HEK293 Cells Quantitative Structure-Activity Relationship Peroxisome Proliferator-Activated Receptors Small Molecule Libraries Retinoid X Receptors
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