胡乔宇

发布者:何靖宇发布时间:2024-03-06浏览次数:1874

胡乔宇副研究员

工作单位:华东师范大学药学院

职称、职务:副研究员

邮箱:qyuhu@hsc.ecnu.edu.cn









个人简介:

胡乔宇,华东师范大学药学院副研究员、硕士生导师;具备量子化学、人工智能、计算生物学、和药物设计等方面的交叉学科学习与研究经历。针对药物研发上游环节中存在的科学问题及技术难点,重点开展药物设计方法和酶促反应机理等的相关基础研究,并通过进一步的应用研究工作带动方法发展,验证方法的可靠性和实用性。在Nat. Commun.Dev. CellPNASACS Catal.WIREs Comput. Mol. Sci.、Eur. J. Med. Chem.J. Chem. Inf. Model.等国际知名期刊上共发表学术论文20余篇,参与申请专利一项专利申请号202111043888.3,作为核心骨干参与并撰写科技部国家重点研发计划子课题一项课题批准号2022YFC3400501上海市科委科技创新行动计划项目批准号22ZR1441400主持上海市科委“计算生物学”专项子课题一项目批准号24JS2830200)和上海市子图信息技术有限公司横向项目一项(项目编号94600-412312-25022),参与撰写国内首本《人工智能与药物设计》专 著。

荣誉及奖励:

上海市超级博士后激励计划Sam&Clara暑期研究奖学金,中国环境科学奖学金,中国海洋石油奖学金国家奖学金

社会兼职:

上海市药学会人工智能专委会青年委员会委员

研究方向:

1. 基于人工智能AI的小分子药物设计

2. 基于深度学习的蛋白降解剂(PROTACs和分子胶)设计

3. 金属酶催化机理研究金属酶衍生物设计

代表性论文:

1. Shaoxuan Wu#, Lin Lin#, Qiaoyu Hu#, Xuebo Yao#, Hongyang Wang#, Shuang Liu, Qingling Liu, Yuehui Xi, Yuzhe Lin, Jianqiao Gong, Ruixing Hu, Wei Zhan, Yi Luo, Guang He, Zhijun Liu, Wei Xiong, Qiuju Wang*, Zhigang Xu*, Fang Bai*, Qing Lu*.Mechano-electrical transduction components TMC1-CIB2 undergo a Ca2+-induced conformational change linked to hearing loss.Developmental Cell. (Q1, IF=10.7)

2. Fenglei Li#, Qiaoyu Hu#, Yongqi Zhou, Hao Yang, Fang Bai*.DiffPROTACs is a deep learning-based generator for proteolysis targeting chimeras. Briefings in Bioinformatics, 2024, 25, bbae358.(Q1, IF=6.8)

3. Pengxuan Ren#, Changyue Yu#, Ruxue Zhang#, Tianqing Nie#, Qiaoyu Hu#, Hui Li, Xianglei Zhang, Xueyuan Zhang, Shiwei Li, Lu Liu, Wenhao Dai, Jian Li, Yechun Xu, Haixia Su*, Leike Zhang*, Hong Liu*, Fang Bai*. Discovery, synthesis and mechanism study of 2, 3, 5-substituted [1, 2, 4]-thiadiazoles as covalent inhibitors targeting 3C-Like protease of SARS-CoV-2. European Journal of Medicinal Chemistry, 2023, 249, 115129.(Q1, IF=6.0)

4. Fenglei Li#, Qiaoyu Hu#, Xianglei Zhang#, Renhong Sun#, Zhuanghua Liu#, Sanan Wu, Siyuan Tian, Xinyue Ma, Zhizhuo Dai, Xiaobao Yang*, Shenghua Gao*, and Fang Bai*. DeepPROTACs is a deep learning-based targeted degradation predictor for PROTACs. Nature Communications, 2022, 13, 7133.(Q1, IF=14.7)

5. Qiaoyu Hu, Vindi M. Jayasinghe-Arachchige, Rajeev Prabhakar*. Degradation of a main plastic pollutant polyethylene terephthalate by two distinct proteases (neprilysin and cutinase-like enzyme).Journal of Chemical Information and Modeling, 2021, 61, 764-776.(Q2, IF=5.6)

6. Qiaoyu Hu, Vindi M. Jayasinghe-Arachchige, Gaurav Sharma, Leonardo F. Serafim, Thomas J. Paul and Rajeev Prabhakar*. Mechanisms of peptide and phosphoester hydrolysis catalyzed by two promiscuous metalloenzymes (insulin degrading enzyme and glycerophosphodiesterase) and their synthetic analogues. WIREs Computational Molecular Science, 2020, 10, e1466. (Q1, IF=16.8)

7. Qiaoyu Hu, Hari Paudyal, Junmei Zhao*, Fang Huo, Katsutoshi Inoue, Huizhou Liu. Adsorptive recovery of vanadium(V) from chromium(VI)-containing effluent by Zr(IV)-loaded orange juice residue.Chemical Engineering Journal, 2014, 248,79-88. (Q1, IF=13.3)

8. Qiaoyu Hu, Junmei Zhao*, Fuchun Wang, Na Sui, Xiaoqin Wang, Fang Huo, Huizhou Liu. Selective extraction of vanadium from chromium by pure [C8mim][PF6]: an anion exchange process.Separation and Purification Technology, 2014, 131,94-101.(Q1, IF=8.1)

科研项目:

科技部重点研发计划(蛋白质动力学分析及预测AI算法发展),2022-2027,参与;

上海市科委“科技创新行动计划”(基于深度学习技术的PROTAC分子设计方法的发展与应用),2022-2025参与;

上海市科委计算生物学专项(药物分子精准生成和优化方法开发与应用研究)子课题2024-2027,主持

上海市子图信息有限公司横向项目(药物靶标的配体分子原位生成与优化方法研究)2024-2027,主持。