INTERNATIONAL JOURNAL OF SCIENTIFIC DEVELOPMENT AND RESEARCH International Peer Reviewed & Refereed Journals, Open Access Journal ISSN Approved Journal No: 2455-2631 | Impact factor: 8.15 | ESTD Year: 2016
open access , Peer-reviewed, and Refereed Journals, Impact factor 8.15
Molecular docking studies, drug-likeness and in-silico ADMET and adverse effect prediction of some novel Spirooxindole derivatives for Alzheimer`s disease
Authors Name:
Tanjima Tarique Laskar
, Monica Arora
Unique Id:
IJSDR2307029
Published In:
Volume 8 Issue 7, July-2023
Abstract:
Spirooxindole is a versatile scaffold which has been extensively studied in pharmaceutical and synthetic chemistry. In the medicinal field, a number of compounds featuring spirooxindole motif have displayed excellent pharmacological activities. Spirooxindole derivatives have a highly precious synthetic framework due to their diversified biological properties and it is found to play a key role in the treatment of Alzheimer’s disease by preventing amyloid fibril formation at early stages of this disease. Recent progress and development in the bioactivity profiles of spirooxindole derivatives have demonstrated their notable position in present-day drug discovery studies. In this study, five spirooxindole derivatives were designed and in-silico studies such as drug likeliness, molecular docking and ADMET studies were performed. All the designed derivatives were found to exhibit docking scores higher than the standard drug Donepezil and toxicity studies has also revealed that the designed compounds didn’t exhibit any toxicity and are considered to be safe. Among the designed derivatives, compound A1 showed highest binding affinity in docking study and it has also showed Blood Brain Barrier (BBB) permeability in ADME studies which is essential for treatment of early stages of Alzheimer disease. Furthermore, it can be considered that the multidirectional development of novel drugs containing this spirooxindole scaffold will continue to be the research hotspot in the field of medicinal chemistry in future.
"Molecular docking studies, drug-likeness and in-silico ADMET and adverse effect prediction of some novel Spirooxindole derivatives for Alzheimer`s disease", International Journal of Science & Engineering Development Research (www.ijsdr.org), ISSN:2455-2631, Vol.8, Issue 7, page no.212 - 227, July-2023, Available :http://www.ijsdr.org/papers/IJSDR2307029.pdf
Downloads:
000338536
Publication Details:
Published Paper ID: IJSDR2307029
Registration ID:207620
Published In: Volume 8 Issue 7, July-2023
DOI (Digital Object Identifier):
Page No: 212 - 227
Publisher: IJSDR | www.ijsdr.org
ISSN Number: 2455-2631
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