Cargando…
Repurposing Drugs for Inhibition against ALDH2 via a 2D/3D Ligand-Based Similarity Search and Molecular Simulation
Aldehyde dehydrogenase-2 (ALDH2) is a crucial enzyme participating in intracellular aldehyde metabolism and is acknowledged as a potential therapeutic target for the treatment of alcohol use disorder and other addictive behaviors. Using previously reported ALDH2 inhibitors of Daidzin, CVT-10216, and...
Autores principales: | Jiang, Wanyun, Chen, Junzhao, Zhang, Puyu, Zheng, Nannan, Ma, Le, Zhang, Yongguang, Zhang, Haiyang |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2023
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10650273/ https://www.ncbi.nlm.nih.gov/pubmed/37959744 http://dx.doi.org/10.3390/molecules28217325 |
Ejemplares similares
-
Repurposing of World-Approved Drugs for Potential Inhibition against Human Carbonic Anhydrase I: A Computational Study
por: Zheng, Nannan, et al.
Publicado: (2023) -
Application of 3D Zernike descriptors to shape-based ligand similarity searching
por: Venkatraman, Vishwesh, et al.
Publicado: (2009) -
Ligand scaffold hopping combining 3D maximal substructure search and molecular similarity
por: Quintus, Flavien, et al.
Publicado: (2009) -
Virtual Screening of FDA-Approved Drugs for Enhanced Binding with Mitochondrial Aldehyde Dehydrogenase
por: Zhou, Boqian, et al.
Publicado: (2022) -
The role of ALDH2 in tumorigenesis and tumor progression: Targeting ALDH2 as a potential cancer treatment
por: Zhang, Hong, et al.
Publicado: (2021)