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Resistin, a Multipotential Therapeutic Target 抵抗素,一个多潜能治疗靶点
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-31 DOI: 10.33263/briac134.384
J. L. Vique‐Sánchez
Being overweight and obese are risk factors that have increased during the COVID-19 pandemic; these factors increase the white adipose tissue (WAT) that increases the release of adipokines (adiponectin, leptin, and resistin). So, obesity provokes the expansion of adipose tissue; it induces changes in their macrophages of pro-inflammatory cytokines (M2 to M1). These changes increase the resistin levels with effects on the metabolism, inflammation process, glucose homeostasis, and insulin resistance, promote cell proliferation and migration, and even serve as a biomarker for tumorigenesis. Therefore, resistin is proposed as a multipotential therapeutic target to treat different diseases, between chronic-degenerative and some types of cancer, because resistin has characteristics that give it a high probability to be a therapeutic target to attend to and prevent various diseases. In different ways, developing new drugs by molecular docking to use molecules with pharmacological characteristics capable of interacting in the regions of resistin to hinder/block the interaction between resistin and their receptors (Δ-DCN, TLR4, and CAP-1) and by promoting health to reduce overweight and obesity, and this could generate lower plasma serum resistin values, so this review remarks the potential of resistin as multipotential therapeutic target.
超重和肥胖是新冠肺炎大流行期间增加的风险因素;这些因素增加了白色脂肪组织(WAT),从而增加了脂肪因子(脂联素、瘦素和抵抗素)的释放。因此,肥胖会导致脂肪组织膨胀;它诱导其巨噬细胞中促炎细胞因子(M2至M1)的变化。这些变化增加抵抗素水平,影响新陈代谢、炎症过程、葡萄糖稳态和胰岛素抵抗,促进细胞增殖和迁移,甚至作为肿瘤发生的生物标志物。因此,抵抗素被提议作为治疗慢性变性和某些类型癌症之间的不同疾病的多潜能治疗靶点,因为抵抗素具有高概率成为治疗和预防各种疾病的治疗靶点的特征。以不同的方式,通过分子对接开发新药,使用具有药理学特征的分子,能够在抵抗素区域相互作用,以阻碍/阻断抵抗素与其受体(Δ-DCN、TLR4和CAP-1)之间的相互作用,并通过促进健康来减少超重和肥胖,这可以产生较低的血浆抵抗素值,因此,本文对抵抗素作为多潜能治疗靶点的潜力进行了综述。
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引用次数: 0
Corrosion Inhibition Investigation of Small Organic Inhibitor on API5LX60 Steel in 3.5% NaCl Solution with CO2 Saturation 小型有机缓蚀剂对API5LX60钢在3.5%NaCl饱和CO2溶液中的缓蚀性能研究
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-31 DOI: 10.33263/briac134.380
CO2 corrosion has emanated as a significant concern in the oil/gas industry owing to the aging of its oilfields. Thus, corrosion protection is significant for maintaining the integrity and sustainability of pipelines, surface facilities, and downhole tools in the oil/gas sector. The present study evaluates the corrosion inhibitory properties of three oxazolone derivatives in CO2 saturated 3.5 weight% NaCl solution against API5LX60 carbon steel used in certain wells and oil/ gas transportation pipelines. The inhibitory behavior was investigated utilizing gravimetric and electrochemical techniques viz. EIS, PDP, and LPR. Electrochemical and Gravimetric technique results were in congruence. EIS asserts capacitive behavior, and PDP affirms oxazolones as mixed inhibitors. SEM and SEM-EDX confirmed the formation of a protective layer by adsorption. At an optimum inhibitor concentration of 200 ppm, inhibitor I exhibited 91.30% inhibition—linear correlation coefficient R2 value of 0.99 avowed adsorptions via Langmuir Isotherm.
由于油田的老化,二氧化碳腐蚀已经成为石油/天然气行业的一个重要问题。因此,在油气行业,防腐蚀对于维护管道、地面设施和井下工具的完整性和可持续性至关重要。本研究评价了三种恶唑酮衍生物在CO2饱和3.5重量% NaCl溶液中对某些井和油气输送管道中使用的API5LX60碳钢的缓蚀性能。利用EIS, PDP和LPR等电化学技术研究了其抑制行为。电化学和重量测定结果一致。EIS确认电容性行为,PDP确认恶唑酮为混合抑制剂。SEM和SEM- edx通过吸附证实了保护层的形成。在最佳浓度为200 ppm时,抑制剂1的抑制率为91.30%,Langmuir等温线的线性相关系数R2值为0.99。
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引用次数: 0
Newly Modified Nanoformulation of Quercetin as Promising Chemotherapeutic Anticancer Agent 新改性槲皮素纳米制剂作为抗癌化疗药物的研究进展
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-31 DOI: 10.33263/briac134.387
Previous studies have demonstrated the potential anticancer effect of quercetin (QUR). However, water insolubility and less bioavailability of QUR reduce its efficiency in cancer therapy. So, this study aims to develop a nanoformulation of quercetin (QURnp) and evaluate its anticancer effect against Ehrlich ascites carcinoma (EAC)-bearing mice compared with native QUR. QUR- loaded pluronic nanoparticles (QURnp) were prepared and characterized. To investigate the anticancer effect of QUR and QURnp, histopathological, ultrastructural, immunohistochemical, cell cycle analysis, western blot, and qRT-PCR studies were performed on EAC tumor cells, as well as antioxidant biomarkers. The results showed that QURnp destroyed tumor cells and significantly elevated antioxidant status with the reduction in MDA and NO levels. QURnp caused mitochondrial degeneration in tumor cells. Furthermore, QURnp completely reduced tumor growth by inhibiting the IL-6/STAT3 signaling pathway, inducing cell cycle arrest at the G1/S phase via overexpression of p27 and suppression of angiogenesis via downregulation in VEGF gene expression. Moreover, immunohistochemical studies indicated that QURnp showed significant inhibition of proliferation marker Ki-67 and anti-apoptotic marker Bcl-2. This study demonstrated that QURnp is a promising anticancer agent superior to native QUR.
先前的研究已经证明槲皮素(QUR)具有潜在的抗癌作用。然而,QUR的水不溶性和生物利用度较低,降低了其在癌症治疗中的效率。因此,本研究旨在开发槲皮素(QURnp)的纳米制剂,并与天然槲皮素进行比较,评价其对埃立克腹水癌(EAC)荷瘤小鼠的抗癌作用。制备并表征了负载QUR的pluronic纳米粒子(QURnp)。为了研究QUR和QURnp的抗癌作用,对EAC肿瘤细胞以及抗氧化生物标志物进行了组织病理学、超微结构、免疫组织化学、细胞周期分析、蛋白质印迹和qRT-PCR研究。结果表明,QURnp破坏肿瘤细胞,并显著提高抗氧化状态,降低MDA和NO水平。QURnp引起肿瘤细胞线粒体变性。此外,QURnp通过抑制IL-6/STAT3信号通路,通过p27的过表达诱导细胞周期停滞在G1/S期,并通过下调VEGF基因表达抑制血管生成,从而完全减少肿瘤生长。此外,免疫组织化学研究表明,QURnp对增殖标志物Ki-67和抗凋亡标志物Bcl-2表现出显著的抑制作用。该研究表明,QURnp是一种有前景的抗癌剂,优于天然QUR。
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引用次数: 1
Synthesis, Characterization, and Dye Removal Applications of Graphene Oxide-Gold Nanocomposite 氧化石墨烯-金纳米复合材料的合成、表征及除染应用
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-31 DOI: 10.33263/briac134.385
Here, we report the facile synthesis of graphene oxide/gold nanocomposite, and dye removal ability as an adsorbent was studied. Sodium citrate as a reducing agent was used to reduce Au (III) ions to the formation of gold nanoparticles on the surface of graphene oxide sheets that were prepared by Hummers’ method. Transmission electron microscopy (TEM), Fourier transform infrared spectroscopy (FT-IR), and X-ray diffraction (XRD) was used to specify nanocomposite synthesis. Adsorption dosage and contact time were investigated and explained as influencing parameters in removing methylene blue and methyl orange. In optimum conditions, the amount of adsorbent 30 mg and contact time 15 min for methylene blue and the amount of adsorbent 30 mg and contact time 25 min for methyl orange were quantitatively removed from 10 mL of wastewater. The pseudo-second-order model explained the kinetic data. Since graphene oxide/gold nanocomposite could be reused reasonably and had adsorptive properties, it tends to be produced as a modest and elective adsorbent to treat wastewater.
在这里,我们报道了氧化石墨烯/金纳米复合材料的简单合成,并研究了作为吸附剂的染料去除能力。以柠檬酸钠为还原剂,在Hummers法制备的氧化石墨烯薄片表面还原Au (III)离子形成金纳米颗粒。采用透射电镜(TEM)、傅里叶变换红外光谱(FT-IR)和x射线衍射(XRD)对纳米复合材料的合成进行了表征。考察了吸附量和接触时间对去除亚甲基蓝和甲基橙的影响。在最佳条件下,亚甲基蓝吸附剂用量为30 mg,接触时间为15 min,甲基橙吸附剂用量为30 mg,接触时间为25 min,对10 mL废水进行定量去除。拟二阶模型解释了动力学数据。由于氧化石墨烯/金纳米复合材料可以合理地重复使用,并且具有吸附性能,因此它倾向于作为一种适度的、选择性的吸附剂来处理废水。
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引用次数: 0
Strengthening the Clumping Paper Properties using Hydroxypropyl Cellulose Applied on a Historical manuscript 13th Century AD. 在公元13世纪的一份历史手稿上应用羟丙基纤维素增强成团纸的性能。
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-08 DOI: 10.33263/briac134.375
The main objective is to find a suitable and effective solution to strengthen agglomerated paper fibers and improve their physical, mechanical, and chemical properties. Many reasons lead to petrification and sticking papers. The alone worker can't lead to petrification and damage because all deterioration factors participate in the provisions of the damage circle on papers. The possible end is the loss of parts or parts or the annihilation of the entire manuscript or book. Given the archaeological and artistic value of the paper manuscripts, hydroxypropyl cellulose was chosen because it is a paper-friendly material. The papers are subject to artificial aging to reach an age like the age of the fossilized manuscript. Then the samples were naturally aged by infecting them with A. niger until they reached adhesion and agglomeration. After that, a separation process was carried out for the leaves. The leaves were consolidated with 2% hydroxypropyl cellulose. Then, an evaluation was carried out to determine the effect of hydroxypropyl cellulose on paper using digital microscopy, scanning electron microscopy, mechanical properties measurement, color change measurement, FTIR measurement, and pH measurement. The results of the examination and evaluation revealed its success in strengthening the papers and improving their properties. Therefore, it was applied to manuscript papers dating back to the thirteenth century AD.
主要目的是找到一种合适而有效的解决方案来增强团聚纸纤维并改善其物理、机械和化学性能。很多原因导致石化和粘纸。单独的工人不会导致石化和损坏,因为所有的劣化因素都参与了纸上损坏圈的规定。可能的结局是部分或部分的损失,或者整个手稿或书籍的毁灭。考虑到纸质手稿的考古和艺术价值,选择羟丙基纤维素是因为它是一种对纸张友好的材料。这些论文经过人工老化,达到了像化石手稿一样的年龄。然后用黑曲霉感染样品,使其自然老化,直到它们达到粘附和团聚。之后,对叶片进行分离处理。叶片用2%羟丙基纤维素固结。然后,使用数字显微镜、扫描电子显微镜、机械性能测量、颜色变化测量、FTIR测量和pH测量进行评估,以确定羟丙基纤维素对纸张的影响。考试和评估的结果表明,它在加固试卷和提高试卷性能方面取得了成功。因此,它被应用于公元十三世纪的手稿。
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引用次数: 0
Quantum Calculation, Docking, ADMET and Molecular Dynamics of Ketal and Non-ketal Forms of D-glucofuranose Against Bacteria, Black & White Fungus, and Triple-Negative Breast Cancer 量子计算,对接,ADMET和分子动力学的酮型和非酮型d -葡聚糖抗细菌,黑白真菌和三阴性乳腺癌
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-08 DOI: 10.33263/briac134.374
D-glucofuranose has potent bioactivity against numerous diseases and pathogens, such as bacteria, fungi, viruses, and cancer. Normally, the ketal form of D-glucofuranose is converted into the non-ketal form by drug metabolism in the human body; as a result, both the ketal and non-ketal forms of D-glucofuranose are considered. To make a comparative biological activity study of ketal and non-ketal species of nine derivatives of D-glucofuranose, two bacteria, black fungus, white fungus, and triple-negative breast cancer, were selected. Firstly, the PASS prediction data from the online PASS tool indicated the probability of pathogenic efficacy through the Pa and Pi parameters. Secondly, the computational studies, such as molecular docking, molecular dynamic, ADMET, drug-likeness, pharmacokinetic, aquatic, and non-aquatic features, were calculated with three FDA-approved drugs, including azithromycin, nystatin, and cyclophosphamide. A comparative study of computational data has been performed where the ketal forms of D-glucofuranose derivatives were found highly biologically active with the satisfaction of the pharmacokinetic parameters, ADMET parameters, and Lipinski rule.
d -葡聚糖对许多疾病和病原体,如细菌、真菌、病毒和癌症具有强大的生物活性。正常情况下,d -葡聚糖在人体内通过药物代谢转化为非酮型;因此,考虑了d -葡萄糖葡萄糖的酮态和非酮态形式。以黑木耳、白木耳和三阴性乳腺癌两种细菌为研究对象,对九种d -葡聚糖衍生物的酮类和非酮类生物活性进行比较研究。首先,通过在线PASS工具的PASS预测数据,通过Pa和Pi参数表示致病功效的概率。其次,以阿奇霉素、制霉菌素、环磷酰胺3种fda批准的药物进行分子对接、分子动力学、ADMET、药物相似性、药代动力学、水生和非水生特征等计算研究。对计算数据进行了比较研究,发现d -葡聚糖衍生物的酮形具有高度的生物活性,符合药代动力学参数、ADMET参数和Lipinski规则。
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引用次数: 5
2D-QSAR Modeling of Chalcone Analogues as Angiotensin Converting Enzyme Inhibitor Chalcone类似物作为血管紧张素转换酶抑制剂的2D-QSAR建模
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-07 DOI: 10.33263/briac134.370
Targeting angiotensin-converting enzyme (ACE) comes out to be an effective mechanism for controlling hypertension. Two-dimensional quantitative structural activity relationship models were generated to predict the ACE inhibitory activity of chalcone analogs. The genetic algorithm- multiple linear regression models (GA-MLR) approach was used to generate highly predictive models using straightforwardly interpretable Py, Estate, Alvadesc, and Padel descriptors. Application of Intelligent consensus modeling confirms that model-2 is statistically robust (R2tr = 0.66, Q2LOO = 0.5621) with good external predictivity (Concordance Correlation Coefficient, CCCex = 0.9109, Q2-F1 = 0.85818, Q2-F2 = 0.85782 and Q2-F3 = 0.88489). Novel analogs designed according to the synthetic route considering structural requirements indicated by the model were found to be satisfactory and could be considered for synthesis and subsequent screening.
靶向血管紧张素转换酶(ACE)是控制高血压的有效机制。建立二维定量结构活性关系模型,预测查尔酮类似物的ACE抑制活性。遗传算法-多元线性回归模型(GA-MLR)方法使用可直接解释的Py、Estate、Alvadesc和Padel描述符来生成高度预测的模型。应用智能共识建模证实,模型-2具有统计稳健性(R2tr = 0.66, Q2LOO = 0.5621),具有良好的外部预测能力(一致性相关系数,CCCex = 0.9109, Q2-F1 = 0.85818, Q2-F2 = 0.85782, Q2-F3 = 0.88489)。考虑模型所示的结构要求,根据合成路线设计的新型类似物是令人满意的,可以考虑进行合成和后续的筛选。
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引用次数: 0
In Silico Drug Repurposing of 9H-Thioxanthene Based FDA-Approved Drugs as Potent Chemotherapeutics Targeting VEGFR-2 and COX-2 fda批准的9h -硫代蒽基药物作为靶向VEGFR-2和COX-2的强效化疗药物的硅药物再利用
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-07 DOI: 10.33263/briac134.372
The approach of using existing drugs initially developed for one disease to treat other indications has found success across medical fields. This article emphasizes the drug repurposing of 9H-thioxanthene based on FDA-approved drugs for anticancer agents precisely targeting VEGFR-2 and COX-2. The investigated 9H-thioxanthene drugs 1-4 were analyzed for Lipinski's drug-likeness rule and ideal ADME parameters. The results show that all calculated physicochemical descriptors and pharmacokinetic properties are within the expected range. 9H-thioxanthene drugs 1-4 were subjected to molecular docking to determine their molecular interactions at the active sites of VEGFR-2 and COX-2. The molecular docking study revealed that all four 9H-thioxanthene drugs 1-4 were able to target VEGFR-2 and COX-2. In the future, these findings will be greatly favorable in augmenting the utility of the development of the investigated drugs 1-4 for cancer therapeutics specifically targeting VEGFR-2 and COX-2.
使用最初为一种疾病开发的现有药物来治疗其他适应症的方法在医学领域取得了成功。本文强调在fda批准的靶向VEGFR-2和COX-2的抗癌药物的基础上,9h -硫代蒽的药物再利用。对所研究的9h -硫代蒽类药物1 ~ 4进行Lipinski药物相似规则和理想ADME参数分析。结果表明,计算得到的理化描述符和药代动力学性质均在预期范围内。对9h -噻吩类药物1-4进行分子对接,以确定它们在VEGFR-2和COX-2活性位点的分子相互作用。分子对接研究显示,4种9h -硫代蒽类药物1-4均能靶向VEGFR-2和COX-2。在未来,这些发现将极大地有利于增加所研究药物1-4在癌症治疗中特异性靶向VEGFR-2和COX-2的效用。
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引用次数: 0
Overview of Nanomaterials and Cellular Interactions 纳米材料与细胞相互作用综述
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-07 DOI: 10.33263/briac134.367
In the last three decades, there has been wide progress in nanomaterials development, and several studies are being performed to show its biological effects and cellular interaction for biomedical applications. Due to the exponential increase in nanomaterial diversity, production, and possibilities of applications in different areas, there is an important concern about its toxicity for humans, animals, and ecosystems. There is a great effort to minimize experimental assays in animals, and this is a commendable initiative. Several alternatives in vitro assays are available; however, several new protocols have been introduced to elucidate the mechanisms of cell-nanomaterial interaction. Wide and fast progress in nanotechnology has been observed. Nonetheless, the nanomaterial interaction with cells or biological systems is still not totally described. In this aspect, this paper is a brief overview of nanomaterials and cellular interactions (nano-bio interaction).
在过去的三十年里,纳米材料的开发取得了广泛的进展,目前正在进行几项研究,以展示其在生物医学应用中的生物效应和细胞相互作用。由于纳米材料的多样性、产量和在不同领域的应用可能性呈指数级增长,人们对其对人类、动物和生态系统的毒性非常担忧。在尽量减少动物实验检测方面做出了巨大努力,这是一项值得称赞的举措。有几种可供选择的体外检测方法;然而,已经引入了几种新的方案来阐明细胞-纳米材料相互作用的机制。纳米技术取得了广泛而快速的进展。尽管如此,纳米材料与细胞或生物系统的相互作用仍然没有完全描述。在这方面,本文对纳米材料和细胞相互作用(纳米生物相互作用)进行了简要概述。
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引用次数: 2
Structural, Characterization, Biological Activity, and DFT Studies on some Novel Ruthenium 2-Aminomethyl Benzimidazole Complexes 新型钌2-氨基甲基苯并咪唑配合物的结构、表征、生物活性及DFT研究
Q3 Biochemistry, Genetics and Molecular Biology Pub Date : 2022-10-07 DOI: 10.33263/briac134.365
Novel 2-aminomethyl benzimidazole (AMBI) ruthenium complexes were synthesized and thoroughly characterized by elemental analysis, spectroscopy (FTIR, 1HNMR, UV–Vis), magnetic measurements, molar conductivity, and thermal analysis techniques. According to analytical data, all complexes demonstrated a 1:1 metal-to-ligand ratio with an octahedral shape. Thermal analysis showed that the complexes have acceptable thermal stability. Cyclic voltammetry was also used to observe their redox actions, and it was found that all of the complexes had electrochemical activity. Using GAUSSIAN 09 W software, the density functional theory (DFT) method and the 3-21G basis set, optimized structures (HOMO & LUMO) of ruthenium complexes (1-4) were carried out. Additionally, the selected quantum and geometric parameters of bond lengths and angles have been determined. The antimicrobial activity of ligand and ruthenium complexes has been evaluated against bacteria (Escherichia coli, Staphylococcus aureus) and fungi (Candida albicans). Two human cancers, HePG-2(hepatocellular carcinoma) and MCF-7 (Michigan Cancer Foundation-7), were tested for cytotoxic activity of complexes. Using the ABTS technique, the antioxidant function of complexes was evaluated. Using a high-affinity Fab sandwich and a specific PCa antibody, molecular docking was utilized to anticipate how the ligand would bind to a human prostate-specific antigen (PSA) immune system receptor (3qum).
合成了新型2-氨基甲基苯并咪唑(AMBI)钌配合物,并通过元素分析、光谱(FTIR、1HNMR、UV-Vis)、磁测量、摩尔电导率和热分析等技术对其进行了全面表征。根据分析数据,所有配合物都表现出1:1的金属与配体的比例,具有八面体形状。热分析表明,配合物具有良好的热稳定性。用循环伏安法观察了它们的氧化还原作用,发现所有的配合物都具有电化学活性。利用GAUSSIAN 09 W软件、密度泛函理论(DFT)方法和3-21G基集,对钌配合物(1-4)的HOMO和LUMO结构进行了优化。此外,还确定了键长和键角的量子参数和几何参数。对配体和钌配合物对细菌(大肠杆菌、金黄色葡萄球菌)和真菌(白色念珠菌)的抑菌活性进行了评价。两种人类癌症,HePG-2(肝细胞癌)和MCF-7(密歇根癌症基金会-7),测试了复合物的细胞毒活性。利用ABTS技术对配合物的抗氧化功能进行了评价。利用高亲和力的Fab三明治和特异性PCa抗体,利用分子对接来预测配体如何与人类前列腺特异性抗原(PSA)免疫系统受体(3qum)结合。
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引用次数: 0
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Biointerface Research in Applied Chemistry
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