• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

一类新型强效抗血管生成和抗氧化吡唑类化合物:合成、生物活性、对接及药物代谢动力学/药物毒性预测研究

A novel class of potent antiangiogenic and antioxidant pyrazoles: synthesis, bioactivity, docking and ADMET studies.

作者信息

Nadigar Siddaram, Gattu Rohith, Ramesh Sanjay, Dharmappa Rekha N, Nanjundaswamy Vijendra Kumar, Ramesh Suhas

机构信息

Postgraduate Department of Chemistry, JSS College of Arts, Commerce & Science (a recognized Research Centre of University of Mysore), Ooty Road, Mysuru-25, Karnataka, India.

Postgraduate Department of Biotechnology, JSS College of Arts, Commerce & Science (a recognized Research Centre of University of Mysore), Ooty Road, Mysuru-25, Karnataka, India.

出版信息

Future Med Chem. 2024;16(21):2285-2300. doi: 10.1080/17568919.2024.2394020. Epub 2024 Sep 12.

DOI:10.1080/17568919.2024.2394020
PMID:39263822
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11622771/
Abstract

Angiogenesis is the hallmark of cancer progression driven by VEGF/VEGFR-2 signalling pathway, inhibition of which could be a solution to tackle the progression of tumour cells and thus arresting their growth. A novel class of pyrazoles was synthesized using arginine and dibromo ketones. Antiangiogenic activity was performed by yolk sac method. Antioxidant activity was evaluated by hydroxyl and superoxide radical scavenging assays. Docking studies were performed to determine the pyrazoles' binding potential with VEGFR-2 receptor and VEGF tyrosine kinase. ADMET properties were calculated using SwissADME and admetSAR for drug-likeness. Compounds showed significant antiangiogenic effects. Compound exhibited effective hydroxyl and superoxide radical scavenging activities. Docking results confirmed the potential binding efficiency with VEGFR-2 receptor over VEGF tyrosine kinase, thus, functioning as competitive-inhibitors. ADMET studies revealed that the compounds possess favourable drug-like qualities. This study presents a novel class of pyrazoles as promising antioxidant and antiangiogenic agents with favourable drug-likeness properties.

摘要

血管生成是由血管内皮生长因子/血管内皮生长因子受体-2(VEGF/VEGFR-2)信号通路驱动的癌症进展的标志,抑制该通路可能是解决肿瘤细胞进展从而阻止其生长的一种方法。使用精氨酸和二溴酮合成了一类新型吡唑。通过卵黄囊法进行抗血管生成活性研究。通过羟基和超氧阴离子自由基清除试验评估抗氧化活性。进行对接研究以确定吡唑与VEGFR-2受体和VEGF酪氨酸激酶的结合潜力。使用SwissADME和admetSAR计算药物代谢动力学(ADMET)性质以评估药物相似性。化合物显示出显著的抗血管生成作用。化合物表现出有效的羟基和超氧阴离子自由基清除活性。对接结果证实了与VEGFR-2受体相比,与VEGF酪氨酸激酶具有更高的潜在结合效率,因此可作为竞争性抑制剂发挥作用。ADMET研究表明这些化合物具有良好的类药物性质。本研究提出了一类新型吡唑作为具有良好类药物性质的有前景的抗氧化剂和抗血管生成剂。

相似文献

1
A novel class of potent antiangiogenic and antioxidant pyrazoles: synthesis, bioactivity, docking and ADMET studies.一类新型强效抗血管生成和抗氧化吡唑类化合物:合成、生物活性、对接及药物代谢动力学/药物毒性预测研究
Future Med Chem. 2024;16(21):2285-2300. doi: 10.1080/17568919.2024.2394020. Epub 2024 Sep 12.
2
ADMET, docking, anticancer evaluations, design and synthesis of pyrazolo[1,5-a]pyrimidines substituted with furan and phenyldiazene as dual EGFR and VEGFR-2 inhibitors.ADMET、对接、抗癌评估、以呋喃和苯基重氮为取代基的吡唑并[1,5-a]嘧啶作为双靶点表皮生长因子受体(EGFR)和血管内皮生长因子受体-2(VEGFR-2)抑制剂的设计与合成
Bioorg Chem. 2025 Aug;163:108746. doi: 10.1016/j.bioorg.2025.108746. Epub 2025 Jul 14.
3
Quinolinone Derivatives Suppress Angiogenesis in Human Umbilical Vein Endothelial Cells by Blocking the VEGF-Induced VEGFR2 Signaling Pathway.喹啉酮衍生物通过阻断血管内皮生长因子(VEGF)诱导的血管内皮生长因子受体2(VEGFR2)信号通路抑制人脐静脉内皮细胞的血管生成。
Arch Pharm (Weinheim). 2025 Jul;358(7):e70040. doi: 10.1002/ardp.70040.
4
Novel pyrazoline-piperazine conjugates as anticancer and antibacterial agents: integrating synthesis, in vitro, QSAR, molecular docking, and MD simulation studies.新型吡唑啉-哌嗪共轭物作为抗癌和抗菌剂:综合合成、体外研究、定量构效关系、分子对接和分子动力学模拟研究
Bioorg Chem. 2025 Aug;163:108703. doi: 10.1016/j.bioorg.2025.108703. Epub 2025 Jun 25.
5
From Bench to Bioactivity: Pyranopyrazole Synthesis, Anticancer, Antimicrobial Efficacy, DFT, Molecular Docking, and Molecular Dynamic Insights.从实验台到生物活性:吡喃并吡唑的合成、抗癌、抗菌功效、密度泛函理论、分子对接及分子动力学见解
Anticancer Agents Med Chem. 2025;25(16):1253-1271. doi: 10.2174/0118715206376210250319053528.
6
Biological and In Silico Studies of a Novel Pyrazolo[3,4-d]Thiazole Derivatives: Anticancer, Anti-Inflammatory, Molecular Docking, and SAR.新型吡唑并[3,4-d]噻唑衍生物的生物学及计算机模拟研究:抗癌、抗炎、分子对接及构效关系
Chem Biodivers. 2025 Jun;22(6):e202403173. doi: 10.1002/cbdv.202403173. Epub 2025 Feb 26.
7
Kinetic studies, molecular docking, and antioxidant activity of novel 1,3-diphenyl pyrazole-thiosemicarbazone with anti-tyrosinase and anti-melanogenesis properties.新型 1,3-二苯基吡唑-缩氨硫脲的酪氨酸酶抑制和黑色素生成抑制活性的动力学研究、分子对接和抗氧化活性。
Bioorg Chem. 2024 Nov;152:107722. doi: 10.1016/j.bioorg.2024.107722. Epub 2024 Aug 13.
8
Examining the 2-aryl-5-nitrobenzofuran-based hydrazones for anti-breast (MCF-7) cancer activity, potential to induce cell cycle arrest and inhibit receptor tyrosine kinases (VEGFR-2 & EGFR).研究基于2-芳基-5-硝基苯并呋喃的腙类化合物的抗乳腺癌(MCF-7)活性、诱导细胞周期停滞的潜力以及抑制受体酪氨酸激酶(VEGFR-2和EGFR)的能力。
Eur J Med Chem. 2025 Nov 15;298:118018. doi: 10.1016/j.ejmech.2025.118018. Epub 2025 Aug 4.
9
Novel benzenesulfonamides as dual VEGFR2/FGFR1 inhibitors targeting breast cancer: Design, synthesis, anticancer activity and in silico studies.新型苯磺酰胺类双重 VEGFR2/FGFR1 抑制剂靶向治疗乳腺癌:设计、合成、抗癌活性及计算机模拟研究。
Bioorg Chem. 2024 Nov;152:107728. doi: 10.1016/j.bioorg.2024.107728. Epub 2024 Aug 17.
10
Anti-vascular endothelial growth factor for diabetic macular oedema: a network meta-analysis.抗血管内皮生长因子治疗糖尿病性黄斑水肿:一项网状Meta分析。
Cochrane Database Syst Rev. 2017 Jun 22;6(6):CD007419. doi: 10.1002/14651858.CD007419.pub5.

本文引用的文献

1
Novel tetrasubstituted 5-Arylamino pyrazoles able to interfere with angiogenesis and Ca mobilization.新型四取代 5-芳基氨基吡唑,能够干扰血管生成和钙动员。
Eur J Med Chem. 2024 Oct 5;276:116715. doi: 10.1016/j.ejmech.2024.116715. Epub 2024 Jul 30.
2
Novel 5-aminopyrazoles endowed with anti-angiogenetic properties: Design, synthesis and biological evaluation.新型具有抗血管生成特性的 5-氨基吡唑类化合物的设计、合成与生物评价。
Eur J Med Chem. 2023 Nov 15;260:115727. doi: 10.1016/j.ejmech.2023.115727. Epub 2023 Aug 15.
3
Conjugation as a Tool in Therapeutics: Role of Amino Acids/Peptides-Bioactive (Including Heterocycles) Hybrid Molecules in Treating Infectious Diseases.结合作用作为治疗手段:氨基酸/肽 - 生物活性(包括杂环)杂合分子在治疗传染病中的作用
Antibiotics (Basel). 2023 Mar 7;12(3):532. doi: 10.3390/antibiotics12030532.
4
In vitro and in vivo assessment of the antioxidant potential of isoxazole derivatives.体外和体内评估异恶唑衍生物的抗氧化潜力。
Sci Rep. 2022 Oct 29;12(1):18223. doi: 10.1038/s41598-022-23050-x.
5
A correlation study of biological activity and molecular docking of Asp and Glu linked bis-hydrazones of quinazolinones.喹唑啉酮的天冬氨酸和谷氨酸连接的双腙的生物活性与分子对接的相关性研究
RSC Adv. 2018 Mar 16;8(19):10644-10653. doi: 10.1039/c8ra00531a. eCollection 2018 Mar 13.
6
Molecular Mechanisms Associated with ROS-Dependent Angiogenesis in Lower Extremity Artery Disease.与下肢动脉疾病中活性氧依赖性血管生成相关的分子机制
Antioxidants (Basel). 2021 May 7;10(5):735. doi: 10.3390/antiox10050735.
7
Tumor Angiogenesis and VEGFR-2: Mechanism, Pathways and Current Biological Therapeutic Interventions.肿瘤血管生成与 VEGFR-2:机制、途径及当前生物治疗干预措施。
Curr Drug Metab. 2021;22(1):50-59. doi: 10.2174/1389200221666201019143252.
8
Discovery of new pyrimidine-5-carbonitrile derivatives as anticancer agents targeting EGFR and EGFR.发现新型嘧啶-5-甲腈衍生物作为针对 EGFR 和 EGFR 的抗癌药物。
Org Biomol Chem. 2020 Oct 7;18(38):7608-7634. doi: 10.1039/d0ob01557a.
9
Design, synthesis, and biological evaluation of new challenging thalidomide analogs as potential anticancer immunomodulatory agents.新型挑战性沙利度胺类似物的设计、合成及生物评价作为潜在的抗癌免疫调节药物。
Bioorg Chem. 2020 Nov;104:104218. doi: 10.1016/j.bioorg.2020.104218. Epub 2020 Sep 1.
10
Design, efficient synthesis, docking studies, and anticancer evaluation of new quinoxalines as potential intercalative Topo II inhibitors and apoptosis inducers.新型喹喔啉类化合物作为潜在的嵌入型拓扑异构酶 II 抑制剂和凋亡诱导剂的设计、高效合成、对接研究及抗癌活性评价。
Bioorg Chem. 2020 Nov;104:104255. doi: 10.1016/j.bioorg.2020.104255. Epub 2020 Sep 2.