Dynamic structure based pharmacophore modeling of the Acetylcholinesterase reveals several potential inhibitors
Acetylcholinesterase is a critical enzyme that regulates neurotransmission by catalyzing the
breakdown of neurotransmitter acetylcholine in synapses of the nervous system. It is an …
breakdown of neurotransmitter acetylcholine in synapses of the nervous system. It is an …
Natural Inhibitors of HMG‐CoA Reductase—An Insilico Approach Through Molecular Docking and Simulation Studies
S Suganya, B Nandagopal… - Journal of cellular …, 2017 - Wiley Online Library
Plant products have always been considered for many important metabolic disorders due to
its abundant medicinal properties. Alarming adverse effects of overuse of statins has been …
its abundant medicinal properties. Alarming adverse effects of overuse of statins has been …
Insight into structural requirements of ACE inhibitory dipeptides: QSAR and molecular docking studies
F Wang, B Zhou - Molecular Diversity, 2020 - Springer
The angiotensin I-converting enzyme (ACE) has been found to exhibit inhibitory capability
against blood pressure. Recently, several ACE inhibitors with different structures have been …
against blood pressure. Recently, several ACE inhibitors with different structures have been …
QSAR study of a series of cholesteryl ester transfer protein inhibitors
MT Chhabria, BN Suhagia, AB Mandhare… - Collection of …, 2011 - cccc.uochb.cas.cz
Cholesteryl ester transfer protein (CETP), an enzyme which catalyses the transfer of
cholesteryl ester from HDL to VLDL, is a promising target for discovery of novel …
cholesteryl ester from HDL to VLDL, is a promising target for discovery of novel …
Transforming non-selective angiotensin-converting enzyme inhibitors in C-and N-domain selective inhibitors by using computational tools
S Alfaro, C Navarro-Retamal… - Mini Reviews in …, 2020 - ingentaconnect.com
The two-domain dipeptidylcarboxypeptidase Angiotensin-I-converting enzyme (EC 3.4. 15.1;
ACE) plays an important physiological role in blood pressure regulation via the …
ACE) plays an important physiological role in blood pressure regulation via the …
Design, synthesis, extra-precision docking, and molecular dynamics simulation studies of pyrrolidin-2-one derivatives as potential acetylcholinesterase inhibitors
Inhibition of acetylcholinesterase (AChE) has been widely explored to develop novel
molecules for management of Alzheimer's disease. In past research finding reported …
molecules for management of Alzheimer's disease. In past research finding reported …
Effect of pH on structural dynamics of HMG-CoA reductase and binding affinity to β-sitosterol
TH Fatoki - Journal of Biomolecular Structure and Dynamics, 2023 - Taylor & Francis
Abstract Human 3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMGCR; EC 1.1. 1.34)
catalyzes the conversion of (3S)-hydroxy-3-methylglutaryl-CoA (HMG-CoA) to mevalonic …
catalyzes the conversion of (3S)-hydroxy-3-methylglutaryl-CoA (HMG-CoA) to mevalonic …
Discovery of novel drug candidates for inhibition of soluble epoxide hydrolase of arachidonic acid cascade pathway implicated in atherosclerosis
AB Gurung, B Mayengbam, A Bhattacharjee - Computational biology and …, 2018 - Elsevier
Soluble epoxide hydrolase (sEH), a key enzyme belonging to cytochrome P450 pathway of
arachidonic acid cascade is a novel therapeutic drug target against atherosclerosis. The …
arachidonic acid cascade is a novel therapeutic drug target against atherosclerosis. The …
Discovery of novel heterocyclic amide-based inhibitors: an integrative in-silico approach to targeting soluble epoxide hydrolase
Inhibition of soluble epoxide hydrolase (sEH) is considered as an emerging druggable
target to reduce blood pressure, improve insulin sensitivity, and decrease inflammation …
target to reduce blood pressure, improve insulin sensitivity, and decrease inflammation …
Molecular modeling of the structures of human and rat pancreatic cholesterol esterases
SR Feaster, DM Quinn, BL Barnett - Protein science, 1997 - Wiley Online Library
Structural models have been generated for rat and human cholesterol esterases by
molecular modeling. For rat cholesterol esterase, three separate models were generated …
molecular modeling. For rat cholesterol esterase, three separate models were generated …