Development of New Potential Inhibitors of β1 Integrins through In Silico Methods—Screening and Computational Validation

Development of New Potential Inhibitors of β1 Integrins through In Silico Methods—Screening and Computational Validation

Integrins are transmembrane receptors that play a critical role in many biological processes which can be therapeutically modulated using integrin blockers, such as peptidomimetic ligands. This work aimed to develop new potential β1 integrin antagonists using modeled receptors based on the aligned c...

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Bibliographic Details
Main Authors: Disraeli Vasconcelos, Beatriz Chaves, Aline Albuquerque, Luca Andrade, Andrielly Henriques, Geraldo Sartori, Wilson Savino, Ernesto Caffarena, João Herminio Martins-Da-Silva
Format: Article
Language:English
Published: MDPI AG 2022-06-01
Series:Life
Subjects:
integrin
VLA-4
peptidomimetic inhibitors
molecular docking
de novo design
molecular dynamics
Online Access:https://www.mdpi.com/2075-1729/12/7/932

Internet

https://www.mdpi.com/2075-1729/12/7/932

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