Center for Computational Toxicology and Exposure, Office of Research and Development, U.S. Environmental Protection Agency, Research Triangle Park, NC, 27711, United States.
Center for Computational Toxicology and Exposure, Office of Research and Development, U.S. Environmental Protection Agency, Research Triangle Park, NC, 27711, United States.
Toxicol Lett. 2022 Apr 15;359:46-54. doi: 10.1016/j.toxlet.2022.02.002. Epub 2022 Feb 7.
Hepatic steatosis is characterized by the intracellular increase of free fatty acids (FFAs) in the form of triglycerides in hepatocytes. This hepatic adverse outcome can be caused by many factors, including exposure to drugs or environmental toxicants. Mechanistically, accumulation of lipids in the liver can take place via several mechanisms such as de novo synthesis and/or uptake of FFAs from serum via high fat content diets. De novo synthesis of FFAs within the liver is mediated by the liver X receptor (LXR), and their uptake into the liver is mediated through the pregnane X receptor (PXR). We investigated the impact of chemical exposure on FFAs hepatic content via activation of LXR and PXR by integrating chemical-specific physiologically based pharmacokinetic (PBPK) models with a quantitative toxicology systems (QTS) model of hepatic lipid homeostasis. Three known agonists of LXR and/or PXR were modeled: T0901317 (antagonist for both receptors), GW3965 (LXR only), and Rifampicin (PXR only). Model predictions showed that T0901317 caused the most FFAs build-up in the liver, followed by Rifampicin and then GW3965. These modeling results highlight the importance of PXR activation for serum FFAs uptake into the liver while suggesting that increased hepatic FAAs de novo synthesis alone may not be enough to cause appreciable accumulation of lipids in the liver under normal environmental exposure levels. Moreover, the overall PBPK-hepatic lipids quantitative model can be used to screen chemicals for their potential to cause in vivo hepatic lipid content buildup in view of their in vitro potential to activate the nuclear receptors and their exposure levels.
肝脂肪变性的特征是肝细胞内游离脂肪酸 (FFAs) 以甘油三酯的形式增加。这种肝不良后果可能由多种因素引起,包括接触药物或环境毒物。从机制上讲,肝脏中的脂质积累可以通过几种机制发生,例如通过高脂肪含量饮食从血清中从头合成和/或摄取 FFAs。肝脏内 FFAs 的从头合成由肝 X 受体 (LXR) 介导,其摄取到肝脏是通过妊娠相关 X 受体 (PXR) 介导的。我们通过将化学物质特异性基于生理学的药代动力学 (PBPK) 模型与肝脏脂质动态平衡的定量毒理学系统 (QTS) 模型相结合,研究了化学暴露通过激活 LXR 和 PXR 对 FFAs 肝含量的影响。模拟了三种已知的 LXR 和/或 PXR 激动剂:T0901317(两种受体的拮抗剂)、GW3965(仅 LXR)和利福平(仅 PXR)。模型预测表明,T0901317 导致肝脏中 FFAs 的积累最多,其次是利福平,然后是 GW3965。这些建模结果强调了 PXR 激活对于血清 FFAs 摄取到肝脏的重要性,同时表明仅增加肝脏 FAAs 的从头合成可能不足以在正常环境暴露水平下导致肝脏中脂质的明显积累。此外,鉴于其体外激活核受体的潜力及其暴露水平,总体 PBPK-肝脏脂质定量模型可用于筛选潜在引起体内肝脏脂质含量增加的化学物质。