mPGES-1 Inhibitor Discovery Based on Computer-Aided Screening: Pharmacophore Models, Molecular Docking, ADMET, and MD Simulations

mPGES-1 is an enzyme, which, when activated by inflammatory factors, can cause prostaglandin E synthesis. Traditional non-steroidal anti-inflammatory drugs are capable of inhibiting prostaglandin production, yet they can also cause gastrointestinal reactions and coagulation disorders. mPGES-1, the e...

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Detalles Bibliográficos
Autores principales: Huang, Qiqi, Lai, Tianli, Wang, Qu, Luo, Lianxiang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10458489/
https://www.ncbi.nlm.nih.gov/pubmed/37630311
http://dx.doi.org/10.3390/molecules28166059

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10458489/
https://www.ncbi.nlm.nih.gov/pubmed/37630311
http://dx.doi.org/10.3390/molecules28166059

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