Screening of cytochrome P450 3A4 inhibitors via in silico and in vitro approaches-Reference-Cited by-同舟云学术

Screening of cytochrome P450 3A4 inhibitors via in silico and in vitro approaches

Published:2018 Issue:61 Volume:8 Page:34783-34792
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Pang Xiaocong¹²³⁴^ORCID,Zhang Baoyue¹²³⁴,Mu Guangyan¹²³⁴,Xia Jie⁵⁶⁷⁸⁴,Xiang Qian¹²³⁴,Zhao Xia¹²³⁴,Liu Ailin⁵⁶⁷⁸⁴,Du Guanhua⁵⁶⁷⁸⁴,Cui Yimin¹²³⁴

Affiliation:

1. Department of Pharmacy

2. Peking University First Hospital

3. Beijing

4. China

5. Institute of Materia Medica

6. Chinese Academy of Medical Sciences

7. Peking Union Medical College

8. Beijing 100050

Abstract

Cytochrome P450 3A4 (CYP3A4) is an important member of the CYP family and responsible for metabolizing a broad range of drugs. It is necessary to establish virtual screening models for predicting CYP3A4 inhibitors.

Funder

Natural Science Foundation of Beijing Municipality

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2018/RA/C8RA06311G

Reference40 articles.

1. Effects of P-Glycoprotein on the Transport of DL0410, a Potential Multifunctional Anti-Alzheimer Agent

2. Relevance of in vitro and clinical data for predicting CYP3A4-mediated herb–drug interactions in cancer patients

3. MDR- and CYP3A4-mediated drug–herbal interactions

4. Inhibition of CYP2C19 and CYP3A4 by Omeprazole Metabolites and Their Contribution to Drug-Drug Interactions

5. Comparison of Different Algorithms for Predicting Clinical Drug-Drug Interactions, Based on the Use of CYP3A4 in Vitro Data: Predictions of Compounds as Precipitants of Interaction

Cited by 17 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Enzyme-mediated drug-drug interactions: a review of in vivo and in vitro methodologies, regulatory guidance, and translation to the clinic;Drug Metabolism Reviews;2024-07-26

2. Molecular Dynamics and Docking Investigation of Flavonol Aglycones against Sulfonylurea Receptor 1 (SUR1) for Anti–diabetic Drug Design;ChemistrySelect;2024-03-07

3. Computational and artificial intelligence-based approaches for drug metabolism and transport prediction;Trends in Pharmacological Sciences;2024-01

4. Development of a Novel CYP3A4 Classifier Model via Site of Metabolism (SOM)-based Molecular Docking, Multivariate Analysis and Molecular Dynamics of Known Substrates and Inhibitors;Journal of Computational Biophysics and Chemistry;2023-11-30

5. Prediction of Cytochrome P450 Inhibition Using a Deep Learning Approach and Substructure Pattern Recognition;Journal of Chemical Information and Modeling;2023-10-21