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[Regulation of Bifidobacterium-short chain fatty acid metabolism and improvement of intestinal toxicity of vinegar-processed Euphorbiae Pekinensis Radix]. [醋制北京大戟双歧杆菌-短链脂肪酸代谢调控及肠道毒性改善]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240912.301
Ling-Jun Ye, Xiao-Fen Xu, Sai-Ya Chen, Huan Zhang, Yi-Xuan Gan, Tao Meng, Rui Ding, Jing Li, Gang Cao, Kui-Long Wang

To explore the mechanism by which vinegar-processed Euphorbiae Pekinensis Radix regulates gut microbiota and reduces intestinal toxicity, this study aimed to identify key microbial communities related to vinegar-induced detoxification and verify their functions. Using a derivatization method, the study measured the content of short-chain fatty acids(SCFAs) in feces before and after vinegar-processing of Euphorbiae Pekinensis Radix. Combined with the results of previous gut microbiota sequencing, correlation analysis was used to identify key microbial communities related to SCFAs content. Through single-bacterium transplantation experiments, the role of key microbial communities in regulating SCFAs metabolism and alleviating the intestinal toxicity of Euphorbiae Pekinensis Radix was clarified. Fecal extracts were then added to a co-culture system of Caco-2 and RAW264.7 cells, and toxicity differences were evaluated using intestinal tight junction proteins and inflammatory factors as indicators. Additionally, the application of a SCFAs receptor blocker helped confirm the role of SCFAs in reducing intestinal toxicity during vinegar-processing of Euphorbiae Pekinensis Radix. The results of this study indicated that vinegar-processing of Euphorbiae Pekinensis Radix improved the decline in SCFAs content caused by the raw material. Correlation analysis revealed that Bifidobacterium was positively correlated with the levels of acetic acid, propionic acid, isobutyric acid, n-butyric acid, isovaleric acid, and n-valeric acid. RESULTS:: from single-bacterium transplantation experiments demonstrated that Bifidobacterium could mitigate the reduction in SCFAs content induced by raw Euphorbiae Pekinensis Radix, enhance the expression of tight junction proteins, and reduce intestinal inflammation. Similarly, cell experiment results confirmed that fecal extracts from Bifidobacterium-transplanted mice alleviated inflammation and increased the expression of tight junction proteins in intestinal epithelial cells. The use of the free fatty acid receptor-2 inhibitor GLPG0974 verified that this improvement effect was related to the SCFAs pathway. This study demonstrates that Bifidobacterium is the key microbial community responsible for reducing intestinal toxicity in vinegar-processed Euphorbiae Pekinensis Radix. Vinegar-processing increases the abundance of Bifidobacterium, elevates the intestinal SCFAs content, inhibits intestinal inflammation, and enhances the expression of tight junction proteins, thereby improving the intestinal toxicity of Euphorbiae Pekinensis Radix.

为探索醋处理的北京大戟调节肠道菌群和降低肠道毒性的机制,本研究旨在鉴定与醋解毒相关的关键微生物群落并验证其功能。采用衍生化法测定了北京大戟炮制前后粪便中短链脂肪酸(SCFAs)的含量。结合之前的肠道菌群测序结果,使用相关性分析确定与SCFAs含量相关的关键微生物群落。通过单菌移植实验,明确了关键微生物群落在调节北京大戟SCFAs代谢和减轻其肠道毒性中的作用。然后将粪便提取物加入Caco-2和RAW264.7细胞共培养体系中,以肠道紧密连接蛋白和炎症因子为指标评估毒性差异。此外,SCFAs受体阻断剂的应用有助于证实SCFAs在减少北京大戟醋加工过程中的肠道毒性中的作用。本研究结果表明,对北京大戟进行醋处理可以改善原料中scfa含量的下降。相关分析表明,双歧杆菌与乙酸、丙酸、异丁酸、正丁酸、异戊酸、正戊酸水平呈正相关。结果:单菌移植实验表明,双歧杆菌可以减轻生北京参诱导的SCFAs含量降低,增强紧密连接蛋白的表达,减轻肠道炎症。同样,细胞实验结果证实,双歧杆菌移植小鼠粪便提取物减轻了炎症,增加了肠上皮细胞紧密连接蛋白的表达。使用游离脂肪酸受体-2抑制剂GLPG0974验证了这种改善效果与SCFAs途径有关。本研究表明双歧杆菌是降低醋制北京大戟中肠道毒性的关键微生物群落。醋处理增加了双歧杆菌的丰度,提高了肠道SCFAs含量,抑制了肠道炎症,增强了紧密连接蛋白的表达,从而改善了北京大麻黄的肠道毒性。
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引用次数: 0
[Cloning and application in synthetic biology of chalcone synthase gene from Lithocarpus litseifolius]. [石竹查尔酮合成酶基因的克隆及其合成生物学应用]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240911.102
Ha-Xiu Zhu, Qing-Xiang Feng, Shu-Fu Sun, Yu-Ping Tan, Xiao-Yan Wei, Ke-Ke Zhang, Chen-Chen Wang, Yan Wang, Da-Yong Li, Jin-Fu Tang, Qiong Luo

Lithocarpus litseifolius is rich in the chalcones phloridzin and trilobatin, the biosynthesis pathways of which have not been fully demonstrated. Chalcone synthase(CHS) is the first key rate-limiting enzyme in the biosynthesis of flavonoids in plants. To explore the functions of CHS gene family in chalcone synthesis of L. litseifolius, this study screened out two CHS genes(LlCHS1 and LlCHS2) from the transcriptome data of this plant, and then bioinformatics analysis and functional characterization were performed for the two genes. The bioinformatics analysis showed that LlCHS1 and LlCHS2 were acidic hydrophilic stable proteins with no transmembrane domain, composed of 395 and 390 amino acid residues, respectively. Both of them contained the characteristic amino acid sequence "WGVLFGFGPGL" and highly conserved active sites(Cys-164, Phe-215, His-303, and Asn-336) of the CHS family. The phylogenetic tree showed that LlCHS1 shared the same clade with similar genes in Aquilaria sinensis, and LlCHS2 was closely related to similar genes in Malus domestica. Under exogenous addition of phloretic acid, co-expression of LlCHS1 or LlCHS2 with Aa4CL from Aromatoleum aromaticum in Escherichia coli catalyzed the production of phloretin from phloretic acid. This study laid a theoretical foundation for revealing the functions of CHS in plants and provided new enzymatic modules for producing phloretin by synthetic biology.

Lithocarpus litseifolius含有丰富的查尔酮、根霉苷和三叶虫苷,其生物合成途径尚未得到充分证实。查尔酮合成酶(Chalcone synthase, CHS)是植物黄酮类化合物生物合成的第一个关键限速酶。为探索CHS基因家族在litseifolius查尔酮合成中的功能,本研究从该植物的转录组数据中筛选出两个CHS基因(LlCHS1和LlCHS2),并对这两个基因进行了生物信息学分析和功能表征。生物信息学分析表明,LlCHS1和LlCHS2为酸性亲水稳定蛋白,无跨膜结构域,分别由395和390个氨基酸残基组成。它们都含有特征氨基酸序列wgvlfgfgpgl_;CHS家族的高度保守活性位点(Cys-164、ph -215、His-303和Asn-336)。系统发育树显示,LlCHS1与中国沉香的相似基因在同一枝上,LlCHS2与家苹果的相似基因有密切的亲缘关系。在外源添加邻苯二甲酸的条件下,大肠杆菌中LlCHS1或LlCHS2与来自芳香油的Aa4CL共表达可催化邻苯二甲酸生成根皮素。本研究为揭示CHS在植物中的功能奠定了理论基础,并为合成生物学生产根皮素提供了新的酶模块。
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引用次数: 0
[Fast identification of origins and cultivation patterns of Astragali Radix by dimension reduction algorithms of hyperspectral data]. [基于高光谱数据降维算法的黄芪产地及栽培模式快速识别]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240827.101
Fei-Xiang Zhou, Hong Jiang, Bao-Lin Guo, Jiao-Yang Luo, Cheng Pan, Mei-Hua Yang, Ye-Lin Liu

This study aims to establish a rapid and non-destructive method for recognizing the origins and cultivation patterns of Astragali Radix. A hyperspectral imaging system(spectral ranges: 400-1 000 nm, 900-1 700 nm; detection time: 15 s) was used to examine the samples of Astragali Radix with different origins and cultivation patterns. The collected hyperspectral datasets were highly correlated and numerous, which required the establishment of stable and reliable dimension reduction and classification models. Firstly, the original spectra were preprocessed by normalization, Gaussian smoothing, and masking. Then, principal component analysis(PCA), partial least squares-discriminant analysis(PLS-DA), and competitive adaptive reweighted sampling(CARS) were performed to reduce the dimension of the hyperspectral data. Finally, support vector machine(SVM), feedforward neural network(FFNN), and convolutional neural network(CNN) were used for data training of the spectral images and spectral curves with dimension reduction. The results showed that applying CARS as a variable selection method before PLS-DA on the hyperspectral data of Astragali Radix achieved the accuracy, precision, and recall of 100% on the CNN test dataset. The F_1-score and area under the curve of ROC(AUC) reached 1. This method is convenient, quick, sample-saving, and non-destructive, providing technical support for rapid identification of the origins and cultivation patterns of Astragali Radix.

本研究旨在建立一种快速、无损的鉴别黄芪来源和栽培模式的方法。高光谱成像系统(光谱范围:400-1 000 nm, 900-1 700 nm;检测时间为15 s),对不同产地和栽培方式的黄芪样品进行检测。所采集的高光谱数据集高度相关且数量众多,需要建立稳定可靠的降维和分类模型。首先,对原始光谱进行归一化、高斯平滑和掩蔽预处理。然后采用主成分分析(PCA)、偏最小二乘判别分析(PLS-DA)和竞争自适应重加权采样(CARS)对高光谱数据进行降维处理。最后,利用支持向量机(SVM)、前馈神经网络(FFNN)和卷积神经网络(CNN)对光谱图像和降维光谱曲线进行数据训练。结果表明,在CNN测试数据集上,将CARS作为PLS-DA前的变量选择方法,在黄芪高光谱数据上获得了100%的准确度、精密度和召回率。f_1评分及ROC曲线下面积(AUC)均达1。该方法简便、快速、省样、无损,可为黄芪的产地及栽培方式的快速鉴定提供技术支持。
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引用次数: 0
[Biological essence of blood stasis-heat syndrome in ischemic stroke and current research status of traditional Chinese medicine prevention and treatment based on thromboinflammation reaction]. [缺血性卒中血瘀热证的生物学本质及基于血栓炎症反应的中医防治研究现状]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240819.701
Jing Zhou, Zhi-Gang Mei

Blood stasis-heat syndrome is one of the common syndromes of ischemic stroke, which is manifested as syndromes of blood stasis and heat during the pathological progression of patients with ischemic stroke, but there is a lack of systematic research on its biological essence. Thromboinflammation reaction is a newly proposed pathological mechanism highly associated with thrombosis and inflammatory reaction, and it refers to the fact that under the mediation of von Willebrand factor(vWF) and the kallikrein-kinin system, thrombosis and inflammatory reaction interact with each other. Activation of T cells and neutrophils further aggravates thrombosis and worsens the pathological progression of ischemic stroke. Therefore, thromboinflammation reaction has the characteristics of the interaction between blood stasis and heat in blood stasis-heat syndrome in traditional Chinese medicine(TCM). Based on the research progress related to thromboinflammation reaction and the clinical syndrome characteristics and biomarkers of blood stasis-heat syndrome in ischemic stroke, this paper put forward the view that thromboinflammation reaction may be the biological foundation of blood stasis-heat syndrome in ischemic stroke. Besides, this paper systematically organized the current applications and research on the mechanism of TCM monomers or compound formulas with the effects of promoting blood circulation to remove blood stasis and clearing heat and detoxifying. It is found that the pharmacological mechanisms are intimately linked to the regulation of biomarkers related to thromboinflammation reaction, verifying that the biological foundation of the blood stasis-heat syndrome in ischemic stroke is thromboinflammation reaction. This paper aims to provide a scientific basis for TCM prevention and treatment strategies for ischemic stroke targeting thromboinflammation reaction.

血瘀热证是缺血性脑卒中的常见证候之一,在缺血性脑卒中患者的病理进展中表现为血瘀热证候,但对其生物学本质缺乏系统的研究。血栓炎症反应是新近提出的一种与血栓形成和炎症反应高度相关的病理机制,是指在血管性血友病因子(vWF)和钾likrein-kinin系统的介导下,血栓形成和炎症反应相互作用。T细胞和中性粒细胞的活化进一步加重血栓形成,使缺血性卒中的病理进展恶化。因此,血栓炎症反应具有中医血瘀热证中血瘀热相互作用的特点。基于血栓炎症反应的相关研究进展,结合缺血性卒中血瘀热证的临床证候特征及生物标志物,本文提出血栓炎症反应可能是缺血性卒中血瘀热证的生物学基础。此外,本文还系统梳理了具有活血化瘀、清热解毒作用的中药单体或复方的应用及机理研究现状。发现其药理机制与血栓炎症反应相关的生物标志物调控密切相关,验证了缺血性卒中血瘀热证的生物学基础是血栓炎症反应。旨在为缺血性脑卒中血栓炎症反应的中医药防治策略提供科学依据。
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引用次数: 0
[Effects of Xihuang Pills on angiogenesis, invasion, and metastasis of p rostate cancer based on FAK/Src/ERK pathway]. [西黄丸基于FAK/Src/ERK通路对前列腺癌血管生成、侵袭和转移的影响]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240909.401
Yan Long, Xin-Jun Luo, Bo Zou, Xin-Jun Dai, Fang-Zhi Fu, Biao Wang, Li-Tong Wu, Yong-Rong Wu, Qing Zhou, Xue-Fei Tian

Based on the focal adhesion kinase(FAK)/steroid receptor coactivator(Src)/extracellular regulated protein kinase(ERK) pathway, this study explored the effects of Xihuang Pills on angiogenesis, invasion, and metastasis in prostate cancer. Liquid chromatography-tandem mass spectrometry(LC-MS/MS) was used to analyze and identify the active ingredients of Xihuang Pills. Bioinformatics techniques, including R language and Perl programs, were employed to analyze the interactions between prostate cancer-related targets and the potential targets of Xihuang Pills. A subcutaneous transplantation tumor model of prostate cancer was established in nude mice using PC3 cells to verify the efficacy and molecular mechanisms of Xihuang Pills. In vitro cellular experiments, including cell proliferation assays(CCK-8), Transwell assays, scratch assays, real-time quantitative reverse transcription PCR, and Western blot, were used to detect the effects of Xihuang Pills on the proliferation, invasion, and migration of prostate cancer cells, as well as on FAK/Src/ERK pathway-related targets. LC-MS/MS identified 99 active ingredients in Xihuang Pills, including gallic acid, gentisic acid, artemisinin, corilagin, phenylbutazone-glucoside, thujic acid, and arecoic acid B. Network pharmacological analysis of the active ingredients in Xihuang Pills revealed that the FAK/Src/ERK signaling pathway was a key pathway in its anti-prostate cancer effects. In vivo and in vitro experiments confirmed that Xihuang Pills significantly inhibited the proliferation, invasion, and migration of PC3 and LNCaP cells, suppressed the growth of PC3 subcutaneous tumors, and reduced the protein expression levels related to the FAK/Src/ERK signaling pathway. In conclusion, the inhibition of angiogenesis, invasion, and metastasis by regulating the FAK/Src/ERK pathway is one of the mechanisms by which Xihuang Pills exert anti-prostate cancer effects.

本研究基于局灶黏附激酶(FAK)/类固醇受体共激活因子(Src)/细胞外调节蛋白激酶(ERK)通路,探讨西黄丸对前列腺癌血管生成、侵袭和转移的影响。采用液相色谱-串联质谱法(LC-MS/MS)对西黄丸的有效成分进行分析鉴定。采用生物信息学技术,包括R语言和Perl程序,分析前列腺癌相关靶点与西黄丸潜在靶点之间的相互作用。利用PC3细胞建立裸鼠前列腺癌皮下移植肿瘤模型,验证西黄丸的疗效及分子机制。体外细胞实验采用细胞增殖法(CCK-8)、Transwell法、scratch法、实时定量反转录PCR法、Western blot法检测西黄丸对前列腺癌细胞增殖、侵袭、迁移的影响,以及对FAK/Src/ERK通路相关靶点的影响。LC-MS/MS鉴定出西黄丸中99种有效成分,包括没食子酸、龙胆酸、青蒿素、芫花素、苯丁酮-葡萄糖苷、枸杞酸、槟榔酸b。对西黄丸有效成分进行网络药理分析,发现FAK/Src/ERK信号通路是其抗前列腺癌的关键通路。体内和体外实验证实,西黄丸显著抑制PC3和LNCaP细胞的增殖、侵袭和迁移,抑制PC3皮下肿瘤的生长,降低FAK/Src/ERK信号通路相关蛋白的表达水平。综上所述,通过调控FAK/Src/ERK通路抑制血管生成、侵袭和转移是西黄丸抗前列腺癌作用的机制之一。
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引用次数: 0
[Mechanism of traditional Chinese medicine in treating vascular calcification in chronic kidney disease based on BMP and SIRT signaling pathways]. [基于BMP和SIRT信号通路的中药治疗慢性肾脏疾病血管钙化的机制]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240918.603
Tian-Hao Sun, Wen Zhang, Jing Li, Yu-Xin Sun, Hong-Shuo Dong, Hong-Tao Yang

Vascular calcification significantly increases the incidence of cardiovascular disease and all-cause mortality patients with chronic kidney disease(CKD), severely affecting their health and lifespan. However, the mechanisms underlying vascular calcification in CKD remain incompletely understood, and the available therapeutic agents are limited. Research has found that the transformation of vascular smooth muscle cells(VSMCs) from a contractile phenotype to an osteoblast-like phenotype is a key step in CKD-related vascular calcification. As research on the pathogenesis of calcification progresses, it has been demonstrated that bone morphogenetic protein(BMP) and silent information regulator(SIRT) signaling pathways can participate in the process of vascular calcification by regulating the osteogenic transdifferentiation of VSMCs. Traditional Chinese medicine(TCM) has accumulated a wealth of valuable experience in the prevention and treatment of kidney diseases over centuries. Modern research indicates that TCM, with its multi-pathway, multi-target, and low-toxicity properties, has shown certain advantages in the prevention and treatment of CKD-related vascular calcification and in improving patients' quality of life. Therefore, in this study, we will introduce the latest research progress of TCM in preventing and treating CKD-related vascular calcification, particularly focusing on the BMP and SIRT signaling pathways, with the aim of providing ideas for the clinical diagnosis and treatment of CKD-related vascular calcification with TCM and related basic research.

血管钙化显著增加慢性肾脏疾病(CKD)患者心血管疾病的发病率和全因死亡率,严重影响其健康和寿命。然而,CKD血管钙化的机制仍然不完全清楚,可用的治疗药物有限。研究发现,血管平滑肌细胞(VSMCs)从收缩表型向成骨细胞样表型的转变是ckd相关血管钙化的关键步骤。随着钙化发病机制研究的深入,已经证明骨形态发生蛋白(BMP)和沉默信息调节因子(SIRT)信号通路可通过调控VSMCs的成骨转分化参与血管钙化过程。几百年来,中医在预防和治疗肾脏疾病方面积累了丰富的宝贵经验。现代研究表明,中医药以其多途径、多靶点、低毒性的特点,在防治ckd相关血管钙化、提高患者生活质量方面显示出一定优势。因此,在本研究中,我们将介绍中医在防治ckd相关血管钙化方面的最新研究进展,重点关注BMP和SIRT信号通路,旨在为临床中医诊治ckd相关血管钙化及相关基础研究提供思路。
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引用次数: 0
[Metabolomics combined with bioinformatics reveals mechanism of Sanhuang Hushen Fangshuai Decoction in treating chronic kidney disease]. [代谢组学结合生物信息学揭示三黄护肾防衰汤治疗慢性肾脏疾病的机制]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240912.501
Cheng-Hua Zhang, Xiao-Yan Li, Hong-Xiang Zheng, Min Zhao, Mei-Feng Zhu, Shu-Qi Min, Xin-Yue Zhang, Shen-Ju Wang

This article aims to analyze the therapeutic effect and probe into the mechanism of Sanhuang Hushen Fangshuai Decoction in treating chronic kidney disease(CKD) based on metabolomics and bioinformatics. The patients with stage 3-4 CKD diagnosed and treated in the Changzhou Hospital of Traditional Chinese Medicine from June 2023 to March 2024 were enrolled in this study. The patients were treated with Sanhuang Hushen Fangshuai Decoction, and the therapeutic effect was evaluated. The serum samples were collected before and after treatment. Ultra-performance liquid chromatography was employed to detect metabolites in the serum, and multivariate statistical analysis was performed. Bioinformatics was employed to screen the active components and targets of the decoction and the potential targets of CKD. The protein-protein interaction(PPI) network of the common targets shared by the decoction and CKD and the drug-component-target network were constructed. The core components and targets were screened according to the correlation degree of the network. The binding between core components and targets was verified by molecular docking. The results showed that Sanhuang Hushen Fangshuai Decoction improved the renal function and reduced proteinuria. Compared with the healthy population, the post-treatment population showed recovery of 54 up-regulated metabolites and 43 down-regulated metabolites. Enrichment analysis results showed that the key pathways included adenosine triphosphate binding cassette(ABC) transport, tryptophan metabolism, and tyrosine metabolism. The results of bioinformatics analysis showed that the core components of Sanhuang Hushen Fangshuai Decoction in treating CKD included kaempferol, β-sitosterol, luteolin, 7-O-methylisolingol, and tanshinone Ⅱ_A. The core targets included TP53, PTGS2, JUN, AKT1, and TNF. Molecular docking results showed that the core components bound well to the target genes. The results of joint pathway analysis suggested that both differential metabolites and key targets were involved in galactose metabolism, nicotinamide metabolism, and other pathways. This study suggests that Sanhuang Hushen Fangshuai Decoction is effective for CKD, and it can regulate multiple abnormal metabolites and participates in multiple metabolic pathways involving amino acids and sugars. The active components such as kaempferol in the decoction may regulate related targets such as TP53 and PTGS2. This study provides a basis for the prevention and treatment of CKD with traditional Chinese medicine.

本文旨在从代谢组学和生物信息学的角度分析三黄护肾防衰汤治疗慢性肾脏疾病(CKD)的疗效,探讨其作用机制。入选常州市中医院2023年6月至2024年3月诊治的3-4期CKD患者。采用三黄护肾防帅汤治疗,观察疗效。分别采集治疗前后血清样本。采用超高效液相色谱法检测血清代谢物,并进行多元统计分析。采用生物信息学方法筛选该煎剂的有效成分和靶点,以及CKD的潜在靶点。构建了汤剂与CKD共有靶点的蛋白-蛋白相互作用(PPI)网络和药物组分-靶点网络。根据网络的关联度筛选核心组件和目标。通过分子对接验证核心组分与靶点之间的结合。结果显示,三黄护肾防帅汤能改善大鼠肾功能,降低蛋白尿。与健康人群相比,治疗后人群有54种上调代谢物和43种下调代谢物恢复。富集分析结果表明,关键途径包括三磷酸腺苷结合盒(ABC)转运、色氨酸代谢和酪氨酸代谢。生物信息学分析结果显示,三黄护肾防瘫汤治疗CKD的核心成分包括山奈酚、β-谷甾醇、木犀草素、7- o -甲基异黄酮醇和丹参酮Ⅱ_A。核心靶点包括TP53、PTGS2、JUN、AKT1和TNF。分子对接结果表明,核心组分与靶基因结合良好。联合通路分析结果表明,差异代谢物和关键靶点都参与了半乳糖代谢、烟酰胺代谢等通路。本研究提示三黄护肾防衰汤对CKD有效,可调节多种异常代谢物,参与氨基酸、糖等多种代谢途径。汤中山奈酚等活性成分可调节TP53、PTGS2等相关靶点。本研究为中医防治慢性肾病提供了依据。
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引用次数: 0
[Establishment of a quality grading standard of Isatidis Radix decoction pieces based on appearance traits and internal quality indexes]. [基于外观性状和内在质量指标的板蓝根饮片质量分级标准的建立]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240910.201
Yan Li, Kang-Ning Fu, Shuai Wang, Li Yang, Zheng-Tao Wang, Rui Wang, Yan-Hong Shi

This study aims to establish a quality grading standard that combines the conventional quality evaluation based on morphological characteristics of traditional Chinese medicine with the modern quality evaluation. Based on the existing standards and market circulation of Isatidis Radix, the diameter and color of Isatidis Radix decoction pieces were selected as the appearance traits for preliminary grading. The effects of internal quality indexes such as moisture, total ash, acid-insoluble ash, ethanol-soluble extractives, and 9 water-soluble components on different grades of decoction pieces were comprehensively compared, and the key grading indexes were determined by t-test. The relevance between appearance traits and the internal quality indexes was investigated by multi-dimensional statistical analyses such as correlation analysis, principal component analysis(PCA), orthogonal partial least squares-discriminant analysis(OPLS-DA), and hierarchical cluster analysis(HCA). Furthermore, the fluorescent substrate was employed to investigate the inhibitory effects of different grades of Isatidis Radix decoction pieces on the neuraminidase of influenza virus. The rationality of the selected grading index components was verified by network pharmacology. The results showed that the diameter of decoction pieces had significantly positive correlations with other index components except moisture. Considering the existing commodity specifications, grading standards, and actual market circulation of Isatidis Radix, the quality grading standard of Isatidis Radix decoction pieces was developed with diameter as the appearance trait and(R,S)-goitrin as the limit index component of being qualified. On this basis, the content of ethanol-soluble extractives, total sinigrin, and total nucleoside were selected for quality grading. The in vitro enzyme activity evaluation showed that the first grade of Isatidis Radix decoction pieces had stronger inhibitory effect on the neuraminidase of influenza virus, and the network pharmacology results showed that the selected index components for quality grading had significant correlations with influenza. This study established a quality grading standard combining appearance traits and internal quality indexes, which provides a scientific basis for improving the existing grading standards and the price and quality of Isatidis Radix decoction pieces.

本研究旨在建立一种将传统的基于形态特征的中药质量评价与现代质量评价相结合的质量分级标准。根据板蓝根现有标准和市场流通情况,选取板蓝根饮片的直径和颜色作为外观性状进行初步分级。综合比较水分、总灰分、酸不溶灰分、醇溶浸出物、9种水溶性组分等内部品质指标对不同等级饮片的影响,并通过t检验确定关键分级指标。采用相关分析、主成分分析(PCA)、正交偏最小二乘判别分析(OPLS-DA)和层次聚类分析(HCA)等多维统计分析方法,研究了外观性状与内在品质指标的相关性。采用荧光底物研究不同等级板蓝根饮片对流感病毒神经氨酸酶的抑制作用。通过网络药理学验证所选分级指标成分的合理性。结果表明:饮片直径与除水分外的其他指标组分呈显著正相关。结合板蓝根现有的商品规格、分级标准和市场流通实际,以直径为外观特征,(R,S)-甲状腺素为合格的限定指标成分,制定了板蓝根饮片的质量分级标准。在此基础上,选取醇溶性提取物、总紫荆素和总核苷的含量进行质量分级。体外酶活性评价表明,一级板蓝根饮片对流感病毒的神经氨酸酶有较强的抑制作用,网络药理学结果表明,质量分级所选择的指标成分与流感有显著相关性。本研究建立了结合外观性状和内在质量指标的板蓝根饮片质量分级标准,为完善现有分级标准及板蓝根饮片的价格和质量提供了科学依据。
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引用次数: 0
[Determination of physical properties and calibration of discrete element simulation parameters for Jianwei Xiaoshi Granules]. [建味消石颗粒物理性质的确定及离散元模拟参数的标定]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240924.301
Zi-Qian Wang, Fan Wu, Zhi-Jian Zhong, Xiao-Rong Luo, Xin-Hao Wan, Jia-Li Liao, Qing Tao, Zhen-Feng Wu

The construction method and simulation parameter settings for the discrete element model of Jianwei Xiaoshi Granules, as the primary material of Jianwei Xiaoshi Tablets, are not yet clear. The accuracy of the simulation model significantly influences the dynamic response characteristics between granules. Therefore, it is necessary to calibrate the parameters to improve the accuracy of the simulation parameters. Using the repose angle of Jianwei Xiaoshi Granules as the response value, the response surface methodology was employed to optimize and calibrate the discrete element parameters. Physical experiments were conducted to determine the physical properties of Jianwei Xiaoshi Granules. Based on the Hertz-Mindlin with Johnson-Kendall-Roberts(JKR) V2 model and virtual simulation methods, a repose angle determination model was constructed in EDEM software. The repose angle was measured using image analysis and numerical fitting methods. The Plackett-Burman experiment was used to screen the initial parameters for significance in the discrete element simulation. The significant parameters were then subjected to a steepest ascent experiment to determine the optimal parameter range. Furthermore, based on the Box-Behnken experiment, a second-order regression equation between significant parameters and repose angle was established, with the repose angle of 37.64° in the physical experiment as the target value. The regression equation was optimized and solved. The significance screening experiment revealed that the granule-granule static friction coefficient, granule-granule rolling friction, and granule-steel plate rolling friction of Jianwei Xiaoshi Granules significantly influenced the simulated repose angle. The optimal parameter combination was found to be 0.330, 0.222, and 0.229. The simulation results with this optimal parameter combination showed that there was no significant difference between the simulated repose angle and the repose angle obtained in the physical experiment, with a relative error of 0.05%, which further validated the reliability of the calibrated discrete element parameters for Jianwei Xiaoshi Granules.

健胃消石颗粒作为健胃消石片的原料药,其离散元模型的构建方法和模拟参数设置尚不明确。模拟模型的准确性对颗粒间的动态响应特性有重要影响。因此,有必要对参数进行标定,以提高仿真参数的精度。以健胃消石颗粒的休止角为响应值,采用响应面法对离散元参数进行优化和标定。通过物理实验对健胃消石颗粒的物理性质进行了测定。基于Hertz-Mindlin - Johnson-Kendall-Roberts(JKR) V2模型和虚拟仿真方法,在EDEM软件中构建了休止角确定模型。采用图像分析和数值拟合的方法测量了静息角。采用Plackett-Burman实验筛选离散元模拟中有意义的初始参数。然后对重要参数进行最陡爬坡实验,确定最佳参数范围。在Box-Behnken实验的基础上,建立了显著性参数与休止角之间的二阶回归方程,以物理实验中的休止角为目标值37.64°。对回归方程进行了优化求解。显著性筛选实验表明,建味消石颗粒的颗粒-颗粒静摩擦系数、颗粒-颗粒滚动摩擦、颗粒-钢板滚动摩擦对模拟休止角影响显著。最优参数组合为0.330、0.222、0.229。该优化参数组合的模拟结果表明,模拟休止角与物理实验所得休止角无显著差异,相对误差为0.05%,进一步验证了建胃消石颗粒标定离散元参数的可靠性。
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引用次数: 0
[Construction of black-bone silky fowl (Gallus gallus domesticus) families based on genetic diversity]. [基于遗传多样性的黑骨肉鸡(Gallus Gallus domesticus)家系构建]。
Q3 Pharmacology, Toxicology and Pharmaceutics Pub Date : 2024-12-01 DOI: 10.19540/j.cnki.cjcmm.20240830.101
Jiao Liu, Hai-Yun Gao, Yuan Yuan, Tian-Rui Liu, Hui Li, Tian Zhang

Black-bone silky fowls(Gallus gallus domesticus) have a long history of medicinal use, with the origin in Taihe county, Jiangxi province. The unclear family composition, inbreeding rate, and effective population size were inconducive to the resource conservation or breed improvement of black-bone silky fowls. A genome-wide analysis was performed to evaluate the genetic diversity of 80 black-bone silky fowls from random mating in three farms in 2021 in terms of minor allele frequency(MAF), expected heterozygosity(H_e), observed heterozygosity(H_o), effective population size(N_e), and runs of homozygosity(ROH). The results showed that a total of 9 641 411 SNPs were passed quality control from 80 black-bone silky fowls. The polymorphic marker ratio, expected heterozygosity, and observed heterozygosity in this population were 0.81, 0.34, and 0.33, respectively, and the average IBS genetic distance of black-bone silky fowls was 0.38±0.008 2. A total of 15 969 ROHs were identified, with the average length of 0.73 Mb, and most of the ROHs were 0~2 Mb. According to inbreeding ROHs, the average inbreeding coefficient was 0.150 9. The high-frequency ROH regions harbored 424 genes, including two genes, SLC13A4 and DDX6, associated with pigmentation. The results showed that the genetic relationship between individuals of black-bone silky fowls was far. The population had experienced a strong decline in size in recent decades, and the inbreeding degree was high. According to the results, an appropriate family construction scheme was proposed for resource conservation and breeding work of black-bone silky fowls.

黑骨乌骨鸡药用历史悠久,原产于江西省泰和县。黑骨乌鸡的家系组成、近交率和有效种群数量不明确,不利于黑骨乌鸡的资源保护和品种改良。本研究从小等位基因频率(MAF)、预期杂合度(H_e)、观察杂合度(H_o)、有效种群数量(N_e)和同源杂合度(ROH)等方面对2021年3个农场随机交配的80只乌骨鸡的遗传多样性进行了全基因组分析。结果表明,80 只乌骨鸡中共有 9 641 411 个 SNPs 通过了质量控制。该群体的多态性标记比、预期杂合度和观察杂合度分别为0.81、0.34和0.33,黑骨乌骨鸡的平均IBS遗传距离为(0.38±0.008)2。共鉴定出15 969个ROH,平均长度为0.73 Mb,大部分ROH长度为0~2 Mb。根据近交ROHs,平均近交系数为0.150 9。高频ROH区域含有424个基因,其中包括与色素沉着有关的SLC13A4和DDX6两个基因。结果表明,黑骨乌骨鸡个体间的遗传关系较远。近几十年来,该种群的数量急剧下降,近亲繁殖程度较高。根据研究结果,为黑骨乌鸡的资源保护和育种工作提出了适当的家系构建方案。
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引用次数: 0
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