Dietary Inhibitors of CYP3A4 Are Revealed Using Virtual Screening by Using a New Deep-Learning Classifier

Keyphrases

• Deep Learning 100%
• Virtual Screening 100%
• Cytochrome P450 3A4 (CYP3A4) 100%
• Bile Acids 66%
• Dietary Compounds 66%
• CYP3A4 Inhibition 66%
• Intestine 33%
• Endocrine System 33%
• Drug Metabolism 33%
• Physiological Mechanism 33%
• Drug Response 33%
• Steroid Hormones 33%
• Endocrine Response 33%
• Prescription Drugs 33%
• Xenobiotics 33%
• High Specificity 33%
• Dietary Supplements 33%
• Food Supplements 33%
• Potential Inhibitors 33%
• Impaired Metabolism 33%
• Herbal 33%
• Phase I Metabolism 33%
• Human Enzymes 33%
• Lipinski's Rule of Five 33%
• Non-inhibitor 33%
• Bilobetin 33%
• Endogenous Hormones 33%
• Picropodophyllin 33%

Pharmacology, Toxicology and Pharmaceutical Science

• CYP3A4 100%
• Virtual Screening 100%
• Bile Acid 40%
• Xenobiotic Agent 20%
• Dietary Supplement 20%
• Steroid Hormone 20%
• Lipinski's Rule of Five 20%

Biochemistry, Genetics and Molecular Biology

• CYP3A4 100%
• Metabolic Pathway 40%
• Bile Acid 40%
• Enzyme 20%
• Intestine Potential 20%