目的 采用網(wǎng)絡(luò)藥理學(xué)技術(shù)探討香青蘭防治癡呆的物質(zhì)基礎(chǔ)和作用機(jī)制。方法 通過(guò)文獻(xiàn)挖掘和藥動(dòng)學(xué)參數(shù)篩選香青蘭含有的活性化合物，通過(guò)檢索DrugBank、GeneCards和OMIM數(shù)據(jù)庫(kù)收集與癡呆相關(guān)的靶標(biāo)；運(yùn)用Cytoscape軟件構(gòu)建香青蘭防治癡呆的蛋白質(zhì)相互作用網(wǎng)絡(luò)；進(jìn)行基因本體和信號(hào)通路富集分析；構(gòu)建香青蘭化合物-關(guān)鍵靶標(biāo)-通路網(wǎng)絡(luò)。結(jié)果 篩選得到香青蘭中藥物活性成分42種，獲得香青蘭防治癡呆的潛在藥物靶標(biāo)90個(gè)，于蛋白質(zhì)互作網(wǎng)絡(luò)中進(jìn)一步篩選得到74個(gè)主要靶標(biāo)，富集得到300條信號(hào)通路、1 465個(gè)生物學(xué)過(guò)程、104個(gè)細(xì)胞組分和108個(gè)分子功能，通過(guò)化合物-靶標(biāo)-通路網(wǎng)絡(luò)中獲得香青蘭發(fā)揮防治癡呆作用的關(guān)鍵化合物，如金合歡素、芹菜素、金圣草（黃）素等黃酮類化合物，以及對(duì)應(yīng)的關(guān)鍵靶標(biāo)與關(guān)鍵信號(hào)通路，如MAPK、APP、MAPT、PI3K等靶標(biāo)與阿爾茨海默病、神經(jīng)營(yíng)養(yǎng)蛋白等通路。結(jié)論 香青蘭防治癡呆具有多成分、多靶標(biāo)、多通路的作用特點(diǎn)。

Objective To explore the material basis and mechanism of Dracocephalum moldavica L. in the prevention and treatment of dementia.Methods The active compounds contained in D. moldavica were screened by literature mining and pharmacokinetic parameters, and the targets related to dementia were collected by searching drugbank, genecards and OMIM databases. Cytoscape software was used to construct the protein interaction network of D. moldavica for the prevention and treatment of dementia. Gene ontology and signal pathway enrichment were analyzed. The key target pathway network of D. moldavica compounds was constructed. Results 42 active components were screened, 90 potential drug targets for the prevention and treatment of dementia were obtained, 74 main targets were further screened in the protein-protein interaction network, and 300 signal pathways, 1 465 biological processes, 104 cell components and 108 molecular functions were enriched. Through the compound-target-pathway network, the key compounds that play a role in the prevention and treatment of dementia, such as acacetin, apigenin, chrysoeriol and other flavonoids, as well as the corresponding key targets and key signal pathways, such as MAPK, APP, MAPT, PI3K and Alzheimer's disease, neurotrophic protein and other pathways were obtained. Conclusion D. moldavica has the characteristics of multi-component, multi-target and multi-channel in the prevention and treatment of dementia.

R285.5

國(guó)家自然科學(xué)基金NSFC-新疆聯(lián)合基金重點(diǎn)支持項(xiàng)目（U1803281）；中國(guó)醫(yī)學(xué)科學(xué)院醫(yī)學(xué)與健康科技創(chuàng)新工程項(xiàng)目（重大協(xié)同創(chuàng)新項(xiàng)目，2017-I2M-1-016）