Design, Synthesis, and Anticancer Assessment of Benzylated Pyrrole-Based Pyrido[2,3-d]Pyrimidines as Thymidylate Synthase Inhibitors [0.03%]
一类苯甲基化吡咯并嘧啶类化合物的设计、合成及抗肿瘤活性和二氢叶酸还原酶抑制活性评估研究
Adarsh Kumar,Sonu Rajput,Ankit Kumar Singh et al.
Adarsh Kumar et al.
Globally, colorectal cancer (CRC) is the second most common cause of cancer-related deaths and the third most common cancer. Thymidylate synthase (TS), a key enzyme involved in DNA biosynthesis, has emerged as a promising molecular target f...
Network Pharmacology-Based Analysis and In Vitro Experiments Validation Reveal Tormentic Acid Induces Apoptosis via PI3K/AKT/HSP90 Pathway in HepG2 Cells [0.03%]
基于网络药理学的分析和体外实验验证：tormentic酸通过PI3K/AKT/HSP90途径诱导HepG2细胞凋亡
Jingyang Lu,Yue Qiu,Facheng Bai et al.
Jingyang Lu et al.
Tormentic acid (TA) has demonstrated potential anti-hepatocellular carcinoma (HCC) effects. This study aimed to explore the anti-HCC effect and underlying mechanisms of TA via network pharmacology, molecular docking, molecular dynamics simu...
EIF2AK2 Globally Binds and Regulates the Expression and Alternative Splicing of T2D-Related Genes in INS1 Cell [0.03%]
EIF2AK2结合并调控INS1细胞中与T2D相关的基因的表达和可变剪接
Lili Ning,Tong Liu,Yuanyuan Lv et al.
Lili Ning et al.
This study aimed to investigate the impact of the RNA-binding protein eukaryotic translation initiation factor 2-alpha kinase 2 (EIF2AK2) gene, also known as PKR, on the condition of islet beta cells. In this study, EIF2AK2 was overexpresse...
Exploring the Therapeutic Potential of Oridonin in the Treatment of Laryngeal Cancer: A Comprehensive Strategy Involving Network Pharmacology, Molecular Docking, Dynamic Simulation, and Experimental Verification [0.03%]
orbining网络药理学、分子对接、动力学模拟和实验验证探索奥利多因治疗喉癌的潜力：一种全面策略
Rui Zhang,Lei Ren,Jiabin Hou et al.
Rui Zhang et al.
Laryngeal cancer (LC) is one of the most common malignant tumors of the head and neck, with high morbidity and mortality rates worldwide. Oridonin (Ori), a natural tetracyclic diterpenoid, exhibits notable anti-tumor properties. However, it...
Paeoniflorin Alleviates Pulmonary Arterial Hypertension by Suppressing TRIM24-Mediated SIRT1 Ubiquitination and NLRP3 Inflammasome Activation [0.03%]
牡丹酚通过抑制TRIM24介导的SIRT1泛素化和NLRP3炎性小体活化来缓解肺动脉高压
Jinbo Zhang,Wenxin Zhang,Bingbing Fan et al.
Jinbo Zhang et al.
This study aimed to investigate the molecular mechanism by which tripartite motif-containing 24 (TRIM24) regulates the ubiquitination of sirtuin 1 (SIRT1) and to explore the protective effect of paeoniflorin (PF) on pulmonary arterial hyper...
Novel Benzimidazole-Urea Phenylalanine Hybrids as Dual-Acting Antimicrobial and Anticancer Agents: In Silico and Biological Evaluation [0.03%]
新型苯甲酰胺脲类化合物作为抗菌抗肿瘤剂的作用机制及评价研究
Tuğçe Deniz Karaca,İrfan Çapan,Yusuf Sert et al.
Tuğçe Deniz Karaca et al.
The emergence of multidrug-resistant microorganisms and the limited therapeutic options for hepatocellular carcinoma (HCC) highlight the urgent need for new molecular scaffolds with dual pharmacological potential. In this study, a novel ser...
Anti-Inflammatory and Antidiabetic Metabolites From Mitragyna diversifolia: In Vitro, Phytochemical, and Computational Studies [0.03%]
Mitragyna diversifolia 的抗炎和抗糖尿病代谢物的体内，植物化学和计算研究
Jing Lu,Hanlei Wang,Kun Zhang et al.
Jing Lu et al.
Mitragyna diversifolia is commonly used to cure diarrhoea in the Bandarban region. However, the impact of anti-inflammatory properties and underlying material basis remains unexplored. This study aimed to determine the anti-inflammatory and...
Computational Based Identified EAAT2 Transporter Activator Attenuates Amyloid-β Induced Excitotoxicity in Primary Neuronal-Astroglial Mixed Culture by Ameliorating Glutamate Clearance [0.03%]
基于计算的EAAT2转运活化剂鉴定通过改善谷氨酸清除来缓解淀粉样蛋白-β诱导的原代神经胶质混合培养中的兴奋毒性
Chennu Manisha,Anusa Ganguly,Nagarjuna Palathoti et al.
Chennu Manisha et al.
Astrocytes play a central role in maintaining synaptic homeostasis, regulating neurotransmitter clearance, and supporting neuronal function, all of which are integral to cognition. In Alzheimer's brain, astrocytic dysfunction contributes si...
Identification and Biological Evaluation of (4H-Thieno[3,2-b]indol-3-yl)methanol as a Tumoricidal Scaffold for an Antineoplastic Agent [0.03%]
作为抗肿瘤剂的(4H-硫吲哚-3-基)甲醇的识别及生物评估
Shi-Hong Zhuang,Yi-Han Chang,Hoang-Thuc Huynh et al.
Shi-Hong Zhuang et al.
Considerable effort has been put into developing YC-1 (lificiguat), an indazole derivative with dual targets including soluble guanylate cyclase (sGC) and hypoxia-inducible factor-1 (HIF-1), as new drug molecules with increased potency. Bui...
Guided Ensemble Stacking Method for Predicting Biological Activities of Compounds [0.03%]
一种化合物生物活性预测的集成 stacking 方法
Azar Shamloo,Jack Tuszynski,Yun Tam et al.
Azar Shamloo et al.
Machine learning (ML)-driven quantitative structure-activity relationship (QSAR) modeling has gained significant attention for predicting compound biological activity based on compounds' structural, chemical, and physical properties because...