SMILES-based QSAR and molecular docking study of xanthone derivatives as α-glucosidase inhibitors
Increasing diabetic population is one of the major health concerns all over the world.
Inhibition of α-glucosidase is a clinically proved and attractive strategy to manage diabetes …
Inhibition of α-glucosidase is a clinically proved and attractive strategy to manage diabetes …
A simple and robust model to predict the inhibitory activity of α-glucosidase inhibitors through combined QSAR modeling and molecular docking techniques
E Izadpanah, S Riahi, Z Abbasi-Radmoghaddam… - Molecular Diversity, 2021 - Springer
Quantitative structure–activity relationships (QSAR) and molecular docking studies have
been performed on a series of 35 α-glucosidase inhibitory derivatives. The QSAR models …
been performed on a series of 35 α-glucosidase inhibitory derivatives. The QSAR models …
In silico design of new α-glucosidase inhibitors through 3D-QSAR study, molecular docking modeling and ADMET analysis
A Khaldan, S Bouamrane, REMA Ajana… - Moroccan Journal of …, 2022 - revues.imist.ma
Abstract α-Glucosidase enzyme is a therapeutic target for diabetes mellitus and its inhibitors
shown a crucial importance in the treatment of this disease. Twenty oxindole based …
shown a crucial importance in the treatment of this disease. Twenty oxindole based …
Discovery of novel coumarin analogs against the α-glucosidase protein target of Diabetes mellitus: Pharmacophore-based QSAR, docking, and molecular dynamics …
Diabetes mellitus (DM) is a chronic metabolic disease, the third killer of mankind. The finding
of potent drugs against diabetes remains challenging. In the present study, coumarin …
of potent drugs against diabetes remains challenging. In the present study, coumarin …
Synthesis, inhibitory activities, and QSAR study of xanthone derivatives as α-glucosidase inhibitors
Y Liu, Z Ke, J Cui, WH Chen, L Ma, B Wang - Bioorganic & medicinal …, 2008 - Elsevier
Xanthones and their derivatives have been reported to exhibit strong inhibitory activities
toward α-glucosidase. To provide deep insight into the correlation between inhibitory …
toward α-glucosidase. To provide deep insight into the correlation between inhibitory …
3D QSAR Analysis of Flavones as Antidiabetic agents
N Sainy, N Dubey, R Sharma, N Dubey… - Research Journal of …, 2022 - indianjournals.com
Diabetes is the most prevailing disease worldwide and emerged as the fourth leading cause
of mortality. Inhibition of intestinal a-Glucosidase enzyme is an effective approach for …
of mortality. Inhibition of intestinal a-Glucosidase enzyme is an effective approach for …
Development of QSAR model using machine learning and molecular docking study of polyphenol derivatives against obesity as pancreatic lipase inhibitor
S Modanwal, AK Maurya, SK Mishra… - Journal of Biomolecular …, 2023 - Taylor & Francis
In developed countries and developing countries, obesity/overweight is considered a major
problem, in fact, it is now recognized as a major metabolic disorder. Additionally, obesity is …
problem, in fact, it is now recognized as a major metabolic disorder. Additionally, obesity is …
k-NN, quantum mechanical and field similarity based analysis of xanthone derivatives as α-glucosidase inhibitors
VH Masand, DT Mahajan, KN Patil… - Medicinal Chemistry …, 2012 - Springer
Herein, we have built up structure–activity relationship (SAR), k-nearest neighbor, quantum
mechanical, field similarity analysis as well as a sufficient number of quantitative SAR …
mechanical, field similarity analysis as well as a sufficient number of quantitative SAR …
Finding structural requirements of structurally diverse α-glucosidase and α-amylase inhibitors through validated and predictive 2D-QSAR and 3D-QSAR analyses
Diabetes mellitus (DM) is a chronic metabolic disorder characterized by hyperglycemic state.
The α-glucosidase and α-amylase are considered two major targets for the management of …
The α-glucosidase and α-amylase are considered two major targets for the management of …
Salicylic acid derivatives as potential α-glucosidase inhibitors: drug design, molecular docking and pharmacokinetic studies
Background Diabetes mellitus (DM) is one of the most defying health risk in the twenty-first
century promoting a high rate of morbidity and mortality that could possibly increase if no …
century promoting a high rate of morbidity and mortality that could possibly increase if no …
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