Elucidating Molecular Interactions of Ten Natural Compounds Targeting E6 HPV High Risk Oncoproteins Using Microsecond Molecular Dynamics Simulations.

CONCLUSIONS: Our results suggest that crocetin, ergosterol peroxide and κ-carrageenan natural products binds strongly to both HPV-16 and HPV-18 and could potentially serve as a scaffolding for further drug development. PMID: 31995016 [PubMed - as supplied by publisher]

https://www.ncbi.nlm.nih.gov/pubmed/31995016?dopt=Abstract

Source: Medicinal Chemistry - January 28, 2020 Category: Chemistry Authors: Meza-Menchaca T, Lizano-Soberón M, Trigos A, Zepeda RC, Medina ME, Galindo-Murillo R Tags: Med Chem Source Type: research