Data di Pubblicazione:
2017
Citazione:
Design of Allosteric Stimulators of the Hsp90 ATPase as New Anticancer Leads / I. D'Annessa, S. Sattin, J. Tao, PENNATI MARZIA, C. Sànchez Martìn, E. Moroni, A. Rasola, N. Zaffaroni, D.A. Agard, BERNARDI ANNA, G. Colombo. - In: CHEMISTRY-A EUROPEAN JOURNAL. - ISSN 0947-6539. - 23:22(2017 Mar 22), pp. 5188-5192. [10.1002/chem.201700169]
Abstract:
Allosteric compounds that stimulate Hsp90 adenosine triphosphatase (ATPase) activity were rationally designed, showing anticancer potencies in the low micromolar to nanomolar range. In parallel, the mode of action of these compounds was clarified and a quantitative model that links the dynamic ligand–protein cross-talk to observed cellular and in vitro activities was developed. The results support the potential of using dynamics-based approaches to develop original mechanism-based cancer therapeutics.
Tipologia IRIS:
01 - Articolo su periodico
Keywords:
allostery; drug design; hsp90; modulators; molecular dynamics; Chemistry (all)
Elenco autori:
I. D'Annessa, S. Sattin, J. Tao, M. Pennati, C. Sànchez Martìn, E. Moroni, A. Rasola, N. Zaffaroni, D.A. Agard, A. Bernardi, G. Colombo
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