豆甾醇是来源于食物中的一种植物不饱和甾醇,在胃癌防治中展现出良好的应用前景。基于网络药理学探讨豆甾醇抗胃癌的作用靶点及分子机制。借助PharmMapper数据库得到药物相关靶点,通过疾病数据库Genecard和OMIM(Online Mendelian Inheri...豆甾醇是来源于食物中的一种植物不饱和甾醇,在胃癌防治中展现出良好的应用前景。基于网络药理学探讨豆甾醇抗胃癌的作用靶点及分子机制。借助PharmMapper数据库得到药物相关靶点,通过疾病数据库Genecard和OMIM(Online Mendelian Inheritance in Man)获得胃癌相关靶点;对潜在标靶进行GO(Gene Ontology)、KEGG(Kyoto Encyclopedia of Genes and Genomes)富集分析得到相关作用通路;随后,利用STRING数据库分析治疗靶点之间蛋白的相互作用,借助Cytoscape3.8.0中CytoHubba插件构建蛋白质相互作用网络以获得Hub基因,预测豆甾醇抗胃癌的作用靶点及机制。借助数据库得到豆甾醇潜在胃癌治疗靶点19个,涉及77个生物过程与10条信号通路;通过蛋白互作网络取排名前5的Hub基因,分别为TERT、MET、SRC、MDM2、HIF1A。结果显示,网络药理学可以准确预测豆甾醇抗胃癌的作用靶点并揭示其分子机制与PI3K(Phosphatidylinositide 3-kinases)/AKT(蛋白激酶B)和RAS(Rat Sarcoma)通路上TERT、MET、SRC、MDM2、HIF1A这些关键基因的表达有关。展开更多
A new Pd-PEPPSI complex(2) with the bromo groups on the para-positions of N-aryl moieties of NHC has been synthesized and characterized by NMR and X-ray single-crystal diffraction. Complex 2 crystallizes in monoclinic...A new Pd-PEPPSI complex(2) with the bromo groups on the para-positions of N-aryl moieties of NHC has been synthesized and characterized by NMR and X-ray single-crystal diffraction. Complex 2 crystallizes in monoclinic, space group P2_1/c with a = 11.8790(8), b = 14.3038(10), c = 15.9905(11) ?, β = 101.291(2)°, V = 2664.4(3) ?3, Z = 4, D_c = 1.722 Mg/m^3, μ = 3.913 mm^(-1), F(000) = 1352, the final R = 0.0682 and wR = 0.1914 for 15113 observed reflections(I > 2σ(I)), R(all data) = 0.0970, w R(all data) = 0.2115, completeness to theta of 25.00 is 100.0% and GOOF = 1.035. Influenced by the electron-withdrawing bromo groups, the Pd-PEPPSI complex(2) showed high catalytic activity for the Suzuki-Miyaura cross-coupling reactions of aryl chlorides and arylboronic acids with a low catalyst loading(0.05 mol%) at room temperature in air.展开更多
文摘豆甾醇是来源于食物中的一种植物不饱和甾醇,在胃癌防治中展现出良好的应用前景。基于网络药理学探讨豆甾醇抗胃癌的作用靶点及分子机制。借助PharmMapper数据库得到药物相关靶点,通过疾病数据库Genecard和OMIM(Online Mendelian Inheritance in Man)获得胃癌相关靶点;对潜在标靶进行GO(Gene Ontology)、KEGG(Kyoto Encyclopedia of Genes and Genomes)富集分析得到相关作用通路;随后,利用STRING数据库分析治疗靶点之间蛋白的相互作用,借助Cytoscape3.8.0中CytoHubba插件构建蛋白质相互作用网络以获得Hub基因,预测豆甾醇抗胃癌的作用靶点及机制。借助数据库得到豆甾醇潜在胃癌治疗靶点19个,涉及77个生物过程与10条信号通路;通过蛋白互作网络取排名前5的Hub基因,分别为TERT、MET、SRC、MDM2、HIF1A。结果显示,网络药理学可以准确预测豆甾醇抗胃癌的作用靶点并揭示其分子机制与PI3K(Phosphatidylinositide 3-kinases)/AKT(蛋白激酶B)和RAS(Rat Sarcoma)通路上TERT、MET、SRC、MDM2、HIF1A这些关键基因的表达有关。
基金Supported by the Natural Science Foundation of Tianjin(No.16JCYBJC19700)the National Natural Science Foundation of China(No.21771138)the Foundation of Development Program of Future Expert in Tianjin Normal University(No.WLQR201704)
文摘A new Pd-PEPPSI complex(2) with the bromo groups on the para-positions of N-aryl moieties of NHC has been synthesized and characterized by NMR and X-ray single-crystal diffraction. Complex 2 crystallizes in monoclinic, space group P2_1/c with a = 11.8790(8), b = 14.3038(10), c = 15.9905(11) ?, β = 101.291(2)°, V = 2664.4(3) ?3, Z = 4, D_c = 1.722 Mg/m^3, μ = 3.913 mm^(-1), F(000) = 1352, the final R = 0.0682 and wR = 0.1914 for 15113 observed reflections(I > 2σ(I)), R(all data) = 0.0970, w R(all data) = 0.2115, completeness to theta of 25.00 is 100.0% and GOOF = 1.035. Influenced by the electron-withdrawing bromo groups, the Pd-PEPPSI complex(2) showed high catalytic activity for the Suzuki-Miyaura cross-coupling reactions of aryl chlorides and arylboronic acids with a low catalyst loading(0.05 mol%) at room temperature in air.
