Targeting Protein–Protein Interactions Perspective

Chung, Chun‐wa; Hann, Michael M.

doi:10.1002/9781118681121.ch20

Cited by 2 publications

(2 citation statements)

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“…Nowadays, exploring the druggability of certain PPIs remains a very challenging topic in drug discovery . In most cases, this is due to the limitations of biophysical assays, which are not always able to overcome obstacles from a structural biology perspective.…”

Section: Discussionmentioning

confidence: 99%

“…Nowadays, exploring the druggability of certain PPIs remains a very challenging topic in drug discovery. 31 In most cases, this is due to the limitations of biophysical assays, which are not always able to overcome obstacles from a structural biology perspective. For this reason, it is necessary to use a wide range of techniques in combination with computational approaches in order to investigate potential hot spots of a PPI complex as well as to monitor the conformational changes of such system in terms of space and time.…”

Section: ■ Conclusionmentioning

confidence: 99%

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Experimental and Computational Druggability Exploration of the 14-3-3ζ/SOS1pS¹¹⁶¹ PPI Interface

Ballone

Picarazzi

Prosser

et al. 2020

J. Chem. Inf. Model.

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The exploration of the druggability of certain protein–protein interactions (PPIs) still remains a challenging task in drug discovery. Here, we present a case study using the 14-3-3-PPI, showing how small molecules can be located that are able to modulate this key oncogenic pathway. A workflow embracing biophysical techniques and MD simulations was developed to evaluate the potential of a 14-3-3ζ PPI system to bind new tool compounds. The significance of the use of computational approaches to compensate for the limitations of experimental techniques is demonstrated.

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Section: Discussionmentioning

confidence: 99%

Section: ■ Conclusionmentioning

confidence: 99%