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Characterizing Drug–Target Interactions: Shifting towards the Clinic
Trends in Pharmacological Sciences, 2020Recently, Perrin et al. reported the application of thermal proteome profiling (TPP), a cellular thermal shift assay with an unbiased proteomics readout to complex tissue samples from model organisms and patient-derived whole blood. This study demonstrates for the first time that TPP enables organ-specific drug target engagement and identification ...
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Expert Opinion on Drug Discovery, 2010
The extent and duration of pharmacological action is determined by the lifetime of drug occupancy on a molecular target. This lifetime is defined by dynamic processes that control the rates of drug association and dissociation from the target. Recently, the term residence time has been coined to describe experimental measurements that can be related to
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The extent and duration of pharmacological action is determined by the lifetime of drug occupancy on a molecular target. This lifetime is defined by dynamic processes that control the rates of drug association and dissociation from the target. Recently, the term residence time has been coined to describe experimental measurements that can be related to
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Protein-Protein Interactions as Drug Targets
2012Over the last two decades, a number of protein-protein interactions (PPIs) have been targeted by the pharmaceutical industry. Pharma as a whole has historically considered PPIs to be undruggable or at the very least high-risk targets, and the relative lack of success in modulating PPIs with small molecules has done little to change this prevailing view.
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Drug-Target Interaction Prediction Based on Transformer
2022Junkai Liu +3 more
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A survey of drug-target interaction and affinity prediction methods via graph neural networks
Computers in Biology and Medicine, 2023Na Han, Aqing Yang, Hongmin Cai
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Current status and future prospects of drug–target interaction prediction
Briefings in Functional Genomics, 2021Xiaoqing Ru +2 more
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CoaDTI: multi-modal co-attention based framework for drug–target interaction annotation
Briefings in Bioinformatics, 2022Jiecong Lin +2 more
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Metapath-aggregated heterogeneous graph neural network for drug–target interaction prediction
Briefings in Bioinformatics, 2023Mei Li, Xiangrui Cai, Sihan Xu
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Lead Optimization: Drug–Target Interactions and the Pharmacophore
2018Norma Dunlap, Donna M. Huryn
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