Molecular docking and in vitro evaluations reveal the role of human cytochrome P450 3A4 in the cross-coupling metabolism of phenolic xenobiotics
L Liu, H Cui, Y Huang, H Yan, Y Zhou, Y Wan - Environmental Research, 2023 - Elsevier
Metabolism generally transforms xenobiotics into more polar and hydrophilic products,
facilitating their elimination from the body. Recently, a new metabolic pathway that …
facilitating their elimination from the body. Recently, a new metabolic pathway that …
Distribution of exogenous and endogenous CYP3A markers and related factors in healthy males and females
Abstract Cytochrome P450 (CYP) 3A is an important drug-metabolizing enzyme in humans.
Assessing CYP3A activity is necessary for predicting therapeutic outcomes or the potential …
Assessing CYP3A activity is necessary for predicting therapeutic outcomes or the potential …
Computational prediction for the metabolism of human UDP-glucuronosyltransferase 1A1 substrates
YB Luo, YY Hou, Z Wang, XM Hu, W Li, Y Li… - Computers in Biology …, 2022 - Elsevier
Abstract UDP-glucuronosyltransferase (UGT) 1A1, one of the most important isoforms in
UGTs superfamily, has attracted increasing concerns for its special role in the clearance and …
UGTs superfamily, has attracted increasing concerns for its special role in the clearance and …
Site of metabolism prediction for oxidation reactions mediated by oxidoreductases based on chemical bond
S He, M Li, X Ye, H Wang, W Yu, W He, Y Wang… - …, 2017 - academic.oup.com
Motivation The metabolites of exogenous and endogenous compounds play a pivotal role in
the domain of metabolism research. However, they are still unclear for most chemicals in our …
the domain of metabolism research. However, they are still unclear for most chemicals in our …
Discovery of Dual ETA/ETB Receptor Antagonists from Traditional Chinese Herbs through in Silico and in Vitro Screening
X Wang, Y Zhang, Q Liu, Z Ai, Y Zhang, Y Xiang… - International Journal of …, 2016 - mdpi.com
Endothelin-1 receptors (ETAR and ETBR) act as a pivotal regulator in the biological effects
of ET-1 and represent a potential drug target for the treatment of multiple cardiovascular …
of ET-1 and represent a potential drug target for the treatment of multiple cardiovascular …
[HTML][HTML] Development and validation of a method for the simultaneous quantification of endogenous steroids metabolized by CYP3A
Abstract Cytochrome P450 (CYP) 3A enzymes, the most important phase 1 drug-
metabolizing enzymes, are responsible for 50% of the metabolism of clinically used drugs …
metabolizing enzymes, are responsible for 50% of the metabolism of clinically used drugs …
Combined docking and quantum chemical study on CYP-mediated metabolism of estrogens in man
Long-term exposure to estrogens seriously increases the incidence of various diseases
including breast cancer. Experimental studies indicate that cytochrome P450 (CYP) …
including breast cancer. Experimental studies indicate that cytochrome P450 (CYP) …
Construction of metabolism prediction models for CYP450 3A4, 2D6, and 2C9 based on microsomal metabolic reaction system
SB He, MM Li, BX Zhang, XT Ye, RF Du… - International Journal of …, 2016 - mdpi.com
During the past decades, there have been continuous attempts in the prediction of
metabolism mediated by cytochrome P450s (CYP450s) 3A4, 2D6, and 2C9. However, it has …
metabolism mediated by cytochrome P450s (CYP450s) 3A4, 2D6, and 2C9. However, it has …
Using chemical bond-based method to predict site of metabolism for five biotransformations mediated by CYP 3A4, 2D6, and 2C9
Although it has been proposed for decades to predict site of metabolism (SOM) by in silico
methods, identifying SOM correctly remains an unsolved fundamental problem and is an …
methods, identifying SOM correctly remains an unsolved fundamental problem and is an …
[PDF][PDF] CYP3A4 介导的睾酮和卡马西平与香芹酚的相互作用
李洋, 衣服新 - 中国药理学与毒理学杂志, 2020 - cjpt.magtechjournal.com
目的考察香芹酚对细胞色素P450 酶3A4 (CYP3A4) 介导的睾酮6β 羟化反应和卡马西平10, 11
环氧化反应的抑制作用. 方法人肝微粒体与香芹酚(或阳性对照酮康唑), 探针底物(睾酮或卡马 …
环氧化反应的抑制作用. 方法人肝微粒体与香芹酚(或阳性对照酮康唑), 探针底物(睾酮或卡马 …