[HTML][HTML] Gates of enzymes

A Gora, J Brezovsky, J Damborsky - Chemical reviews, 2013 - ACS Publications
Enzymes are very efficient catalysts that are essential for the functioning of living organisms.
The low efficiency of biocatalysts produced de novo relative to those that have evolved …

Multitarget compounds bearing tacrine-and donepezil-like structural and functional motifs for the potential treatment of Alzheimer's disease

L Ismaili, B Refouvelet, M Benchekroun, S Brogi… - Progress in …, 2017 - Elsevier
Alzheimer's disease is a multifactorial and fatal neurodegenerative disorder characterized
by decline of cholinergic function, deregulation of other neurotransmitter systems, β-amyloid …

Acetylcholinesterase: from 3D structure to function

H Dvir, I Silman, M Harel, TL Rosenberry… - Chemico-biological …, 2010 - Elsevier
By rapid hydrolysis of the neurotransmitter, acetylcholine, acetylcholinesterase terminates
neurotransmission at cholinergic synapses. Acetylcholinesterase is a very fast enzyme …

Structure-based search for new inhibitors of cholinesterases

M Bajda, A Więckowska, M Hebda, N Guzior… - International journal of …, 2013 - mdpi.com
Cholinesterases are important biological targets responsible for regulation of cholinergic
transmission, and their inhibitors are used for the treatment of Alzheimer's disease. To …

Discovery and structure–activity relationships of a highly selective butyrylcholinesterase inhibitor by structure-based virtual screening

SN Dighe, GS Deora, E De la Mora… - Journal of medicinal …, 2016 - ACS Publications
Structure-based virtual screening of two libraries containing 567 981 molecules was used to
discover novel, selective BuChE inhibitors, which are potentially superior symptomatic …

Functional aspects of protein flexibility

K Teilum, JG Olsen, BB Kragelund - Cellular and Molecular Life Sciences, 2009 - Springer
Proteins are dynamic entities, and they possess an inherent flexibility that allows them to
function through molecular interactions within the cell, among cells and even between …

A comprehensive review of cholinesterase modeling and simulation

D De Boer, N Nguyen, J Mao, J Moore, EJ Sorin - Biomolecules, 2021 - mdpi.com
The present article reviews published efforts to study acetylcholinesterase and
butyrylcholinesterase structure and function using computer-based modeling and simulation …

Acetylcholinesterase inhibitors: a patent review (2008–present)

M Pohanka - Expert opinion on therapeutic patents, 2012 - Taylor & Francis
Introduction: Both acetylcholinesterase (AChE) and butyrylcholinesterase (BChE) are
present in the body in large amounts. AChE is an important part of the cholinergic nervous …

Acetylcholinesterase: a primary target for drugs and insecticides

S Thapa, M Lv, H Xu - Mini reviews in medicinal chemistry, 2017 - ingentaconnect.com
Background: Acetylcholinesterase is a serine hydrolase that terminates the action of the
neurotransmitter acetylcholine by hydrolyzing it into acetic acid and choline. Objective: The …

Evaluation of 4-aminoquinoline derivatives with an n-octylamino spacer as potential multi-targeting ligands for the treatment of Alzheimer's disease

A Matošević, DM Opsenica, M Spasić… - Chemico-biological …, 2023 - Elsevier
The most successful therapeutic strategy in the treatment of Alzheimer's disease (AD) is
directed toward increasing levels of the neurotransmitter acetylcholine (ACh) by inhibition of …