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Updated: Jul 1, 2025

Biosensor-based High Throughput Biopanning and Bioinformatics Analysis Strategy for the Global Validation of Drug-protein Interactions
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Published on: December 1, 2020

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用人工智能引导的蛋白质蛋白相互作用药物发现管道确定了一种SARS-CoV-2抑制剂

Philipp Trepte1,2, Christopher Secker3,4, Julien Olivet5,6,7,8,9

  • 1Proteomics and Molecular Mechanisms of Neurodegenerative Diseases, Max Delbrück Center for Molecular Medicine in the Helmholtz Association, 13125, Berlin, Germany. philipp.trepte@imba.oeaw.ac.at.

Molecular systems biology
|March 12, 2024
PubMed
概括

这项研究引入了一条用于识别和验证蛋白质与蛋白质相互作用 (PPI) 药物点的管道. 它通过准NSP10-NSP16复合体,成功地确定了一种抑制SARS-CoV-2复制的化合物.

关键词:
阿尔法折叠是什么意思阿尔法折叠机器学习 机器学习蛋白质 蛋白质 相互作用这就是SARS-CoV-2病毒.虚拟流 (VirtualFlow) 是一个虚拟流.

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Protein-protein Interfaces02:04

Protein-protein Interfaces

Many proteins form complexes to carry out their functions, making protein-protein interactions (PPIs) essential for an organism's survival. Most PPIs are stabilized by numerous weak noncovalent chemical forces. The physical shape of the interfaces determines the way two proteins interact. Many globular proteins have closely-matching shapes on their surfaces, which form a large number of weak bonds. Additionally, many PPIs occur between two helices or between a surface cleft and a...
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Protein Networks

An organism can have thousands of different proteins, and these proteins must cooperate to ensure the health of an organism. Proteins bind to other proteins and form complexes to carry out their functions. Many proteins interact with multiple other proteins creating a complex network of protein interactions.
These interactions can be represented through maps depicting protein-protein interaction networks, represented as nodes and edges. Nodes are circles that are representative of a protein,...
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