机构

• 上海药物研究所 [44]
• 新疆理化技术研究所 [8]
• 化学研究所 [7]
• 大连化学物理研究所 [3]
• 金属研究所 [2]
• 数学与系统科学研究院 [2]
• 更多

采集方式

• OAI收割 [83]
• iSwitch采集 [3]

内容类型

• 期刊论文 [85]
• 学位论文 [1]

发表日期

• 2025 [1]
• 2024 [7]
• 2023 [2]
• 2022 [3]
• 2021 [3]
• 2020 [8]
• 更多

学科主题

• Biochemist... [2]
• Biochemist... [1]
• Biophysics [1]
• Integrativ... [1]

筛选

浏览/检索结果: 共86条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序作者升序作者降序题名升序题名降序发表日期升序发表日期降序 Contrastive learning-based drug screening model for GluN1/GluN3A inhibitors 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2025, 页码: 13 作者:  Li, Kun;  Zeng, Yue;  Xiong, Yi-da;  Wu, Hao-chen   |  收藏  |  浏览/下载：3/0  |  提交时间：2025/08/20 drug-target affinity prediction  virtual screening  contrastive learning  graph neural network  N-methyl-D-aspartate (NMDA) receptors  GluN3A subunit.   Interaction-Based Inductive Bias in Graph Neural Networks: Enhancing Protein-Ligand Binding Affinity Predictions From 3D Structures 期刊论文  OAI收割 IEEE TRANSACTIONS ON PATTERN ANALYSIS AND MACHINE INTELLIGENCE, 2024, 卷号: 46, 期号: 12, 页码: 8191-8208 作者:  Yang, Ziduo;  Zhong, Weihe;  Lv, Qiujie;  Dong, Tiejun;  Chen, Guanxing   |  收藏  |  浏览/下载：29/0  |  提交时间：2025/01/14 Proteins  Programmable logic arrays  Three-dimensional displays  Predictive models  Graph neural networks  Data models  Convolution  Protein-ligand binding affinity  graph neural networks  inductive bias  drug-target interaction  structure-based virtual screening   TRIP13-a potential drug target in cancer pharmacotherapy 期刊论文  OAI收割 BIOORGANIC CHEMISTRY, 2024, 卷号: 151, 页码: 11 作者:  Bunu, Samuel Jacob;  Cai, Haiyan;  Wu, Leyun;  Zhang, Hui;  Zhou, Zhaoyin   |  收藏  |  浏览/下载：23/0  |  提交时间：2024/09/26 AAA plus ATPase  TRIP13  Cancer  Drug target  Small-molecule inhibitors   In silico off-target profiling for enhanced drug safety assessment 期刊论文  OAI收割 ACTA PHARMACEUTICA SINICA B, 2024, 卷号: 14, 期号: 7, 页码: 2927-2941 作者:  Liu, Jin;  Gui, Yike;  Rao, Jingxin;  Sun, Jingjing;  Wang, Gang   |  收藏  |  浏览/下载：19/0  |  提交时间：2024/08/22 Drug safety  Off-target prediction  Adverse drug reactions  Toxicity  Molecular representation  Artificial intelligence   Substrate and Functional Diversity of Protein Lysine Post-translational Modifications 期刊论文  OAI收割 GENOMICS PROTEOMICS & BIOINFORMATICS, 2024, 卷号: 22, 期号: 1, 页码: 21 作者:  Hao, Bingbing;  Chen, Kaifeng;  Zhai, Linhui;  Liu, Muyin;  Liu, Bin   |  收藏  |  浏览/下载：19/0  |  提交时间：2024/12/16 Protein lysine PTM  Regulatory enzyme  PTM crosstalk  Drug target  Acylation   Eliminating drug target interference with specific antibody or its F(ab′)2 fragment in the bridging immunogenicity assay 期刊论文  OAI收割 BIOANALYSIS, 2024, 页码: 14 作者:  Deng, Xiaojie;  Hou, Yingying;  Yuan, Wenyi;  Yang, Hongzhou;  Guo, Ruowen   |  收藏  |  浏览/下载：318/0  |  提交时间：2024/04/09 anti-drug antibody  IgE  immunogenicity  mitigation  target interference   Drug development advances in human genetics-based targets 期刊论文  OAI收割 MEDCOMM, 2024, 卷号: 5, 期号: 2, 页码: e481 作者:  Zhang, Xiaoxia;  Yu, Wenjun;  Li, Yan;  Wang, Aiping;  Cao, Haiqiang   |  收藏  |  浏览/下载：14/0  |  提交时间：2025/06/04 drug development  drug target  genetic variation  genome-wide association studies  whole-exome sequencing  whole-genome sequencing   A proteomic landscape of pharmacologic perturbations for functional relevance 期刊论文  OAI收割 JOURNAL OF PHARMACEUTICAL ANALYSIS, 2024, 卷号: 14, 期号: 1, 页码: 128-139 作者:  Liu, Zhiwei;  Jiang, Shangwen;  Hao, Bingbing;  Xie, Shuyu;  Liu, Yingluo   |  收藏  |  浏览/下载：37/0  |  提交时间：2024/04/09 Proteomics  Drug  Perturbation  Drug target  Drug combination   Structural insights into the interaction of three Y- shaped ligands with PI3Kα 期刊论文  OAI收割 PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2023, 卷号: 120, 期号: 34, 页码: 9 作者:  Zhou, Qingtong;  Liu, Xiao;  Neri, Dario;  Li, Wenxin;  Favalli, Nicholas   |  收藏  |  浏览/下载：38/0  |  提交时间：2023/12/08 phosphoinositide 3-kinase  drug target  ligand  binding pocket  chemical scaffold   ETCM v2.0: An update with comprehensive resource and rich annotations for traditional Chinese medicine 期刊论文  OAI收割 ACTA PHARMACEUTICA SINICA B, 2023, 卷号: 13, 期号: 6, 页码: 2559-2571 作者:  Zhang, Yanqiong;  Li, Xin;  Shi, Yulong;  Chen, Tong;  Xu, Zhijian   |  收藏  |  浏览/下载：80/0  |  提交时间：2023/10/17 Traditional Chinese medicine  Database  Target identification  Network visualization  New drug research and development  Molecular mechanism  Quality marker  Drug repurposing