2022
DOI: 10.3389/fneur.2022.977953
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Potential mechanism of the Shunaoxin pill for preventing cognitive impairment in type 2 diabetes mellitus

Abstract: ObjectiveThis study aims to analyze the efficacy and mechanism of action of the Shunaoxin pill in preventing cognitive impairment in diabetic patients using network pharmacology.MethodsThe main active compounds of the Shunaoxin pills and their action targets were identified via the TCMSP and Batman-TCM databases. The GEO database was used to identify the genes in type 2 diabetic individuals associated with cognitive impairment. Subsequently, a common target protein-protein interaction (PPI) network was constru… Show more

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“…The best binding conformations were selected from 50 lowest energy docked structures based on a criterion combining the lowest binding energy and root-mean-square deviation values (RMSD <1) ( Bahuguna et al, 2022 ), and were displayed by PyMOL. Here, if the binding energy of the ligand <0, the receptors bind spontaneously, and if the binding energy is ≤ −5.0 kcal/mol, they form a stable docking ( Guo et al, 2022 ).…”
Section: Methodsmentioning
confidence: 99%
“…The best binding conformations were selected from 50 lowest energy docked structures based on a criterion combining the lowest binding energy and root-mean-square deviation values (RMSD <1) ( Bahuguna et al, 2022 ), and were displayed by PyMOL. Here, if the binding energy of the ligand <0, the receptors bind spontaneously, and if the binding energy is ≤ −5.0 kcal/mol, they form a stable docking ( Guo et al, 2022 ).…”
Section: Methodsmentioning
confidence: 99%