Analyzing Kinase Similarity in Small Molecule and Protein Structural Space to Explore the Limits of Multi-Target Screening

While selective inhibition is one of the key assets for a small molecule drug, many diseases can only be tackled by simultaneous inhibition of several proteins. An example where achieving selectivity is especially challenging are ligands targeting human kinases. This difficulty arises from the high...

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Udgivet i:Molecules
Main Authors: Schmidt, Denis, Scharf, Magdalena M., Sydow, Dominique, Aßmann, Eva, Martí-Solano, Maria, Keul, Marina, Volkamer, Andrea, Kolb, Peter
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2021
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Article
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7865522/
https://ncbi.nlm.nih.gov/pubmed/33530327
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26030629
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