Title : In vitro and in silico evaluation of fucosterol from Sargassum horridum as potential human acetylcholinesterase inhibitor.

Pub. Date : 2019 Aug

PMID : 30088792






2 Functional Relationships(s)
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1 Structural analysis revealed that neostigmine reaches the AChE binding site reported elsewhere, whereas fucosterol can act as a no-competitive and competitive acetylcholinesterase inhibitor, in agree with kinetic enzymatic experiments. Neostigmine acetylcholinesterase (Cartwright blood group) Homo sapiens
2 Binding free energy calculations revealed that fucosterol reaches the acetylcholinesterase binding site with higher affinity than neostigmine, which is according to experimental results. Neostigmine acetylcholinesterase (Cartwright blood group) Homo sapiens