Molecular modeling and docking analysis of aspirin with pde7b in the context of neuro-inflammation.

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Department of Pharmacology, Sri Ramachandra Medical College and Research Institute, Sri Ramachandra Institute of Higher Education and Research (DU), Porur, Chennai-116, Tamil Nadu, India.

Published: February 2020

The PDE7B gene encodes 3'5'-cyclic nucleotide phosphodiesterase (PDE) and a known target in cognitive impairments. Therefore, it is of interest to design and development of potential inhibitors with PDE7B with improved binding features. We document that the amino acid residues such as H186, K190, and G113 of PDE7B protein showed crucial interactions with aspirin for further consideration in this context.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7196167PMC
http://dx.doi.org/10.6026/97320630016183DOI Listing

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