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320070

Study, Docking, In Silico ADME and Bio-Evaluation of Novel Hetero-Aromatic Amino Acid Derivatives as Potential Anti-Epileptic Agents

Article

Last updated: 01 Jan 2025

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Subjects

-

Tags

Pharmaceutical Chemistry

Abstract

A series of 1-(3-(1H-indol-3-yl)-1-(naphthalen-2-yl)allyl)-1,4-dihydroquinoline-4-carboxylic acid analogues (Va-j) were prepared, then tested for anticonvulsant efficacy. The analogues were tested using "gold standard procedures," which showed notable activity, particularly in chemically induced seizures. In the MES model and the scPTZ model, compounds Vf, Ve, Vg, and Vc were identified to be the most potent of the series. In order to assess motor damage, all synthetic analogues were also tested for acute neurotoxicity using the rotarod method. For the most part, all synthetic counterparts passed the test. The research also offers ADME predictions for all 10 congeners produced and carefully analysed each parameter. Additionally, the GABA-A target protein was used in research on molecular docking. The results of molecular docking revealed significant interactions at the active site of GABA-A with Val B:199, Arg A:180, Phen B:200, Ala B:201 and Lys A:173, and the outcomes were good and in agreement with in vivo findings. The compounds with EDG at position 6 or unsubstituted analogues were found to be most active where as those with electron donating group have less activity. New anticonvulsant medications may be created as a result of more research on these substances.

DOI

10.21608/ejchem.2023.232868.8534

Keywords

anticonvulsant activity, GABA-A, Indole, Molecular docking, Quinoline

Authors

First Name

Faez

Last Name

Alshehri

MiddleName

F

Affiliation

Department of Medical Laboratories, College of Applied Medical Sciences, Shaqra University, Shaqra 11961, Saudi Arabia

Email

falshehri@su.edu.sa

City

Saudi Arabia

Orcid

-

First Name

Zafer

Last Name

Alshehri

MiddleName

S

Affiliation

Department of Medical Laboratories, College of Applied Medical Sciences, Shaqra University, Shaqra 11961, Saudi Arabia

Email

zaf@su.edu.sa

City

Saudi Arabia

Orcid

-

First Name

sharif

Last Name

Alhjlah

MiddleName

-

Affiliation

Department of Medical Laboratories, College of Applied Medical Sciences, Shaqra University, Shaqra 11961, Saudi Arabia

Email

alhjlah@su.edu.sa

City

Shaqra, KSA

Orcid

-

First Name

nagwan

Last Name

Salama

MiddleName

M

Affiliation

Department of Medical Pharmacology, Faculty of Medicine, Cairo University, Egypt.

Email

nagwan.salama@kasralainy.edu.eg

City

cairo

Orcid

-

First Name

Zahra

Last Name

Alamshany

MiddleName

M

Affiliation

Chemistry Department, Faculty of Science, King Abdulaziz University, Jeddah 21551, Saudi Arabia

Email

zalamshany@kau.edu.sa

City

Saudi Arabia

Orcid

-

First Name

Mohammed

Last Name

Arshad

MiddleName

F

Affiliation

Department of Research and Scientific Communications, Isthmus Research and Publishing House, U-13, Near Badi Masjid, Pulpehlad Pur, New Delhi 110044, India

Email

faiz51147@gmail.com

City

New Delhi

Orcid

-

First Name

Ahmed

Last Name

Elkirdasye

MiddleName

F

Affiliation

Departmentof Biochemistry and Chemistry of Nutrition, Faculty of Veterinary Medicine, University of Sadat City, Sadat City, 32897, Egypt.

Email

ahmed.elkerdasy@vet.usc.edu.eg

City

Egypt

Orcid

-

First Name

Allam

Last Name

Hassan

MiddleName

A.

Affiliation

Department of Chemistry, Faculty of Science, Suez University, Suez 43221, Egypt

Email

allam.hassan@sci.suezuni.edu.eg

City

-

Orcid

-

Volume

67

Article Issue

4

Related Issue

45406

Issue Date

2024-04-01

Receive Date

2023-09-03

Publish Date

2024-04-01

Page Start

193

Page End

206

Print ISSN

0449-2285

Online ISSN

2357-0245

Article File

EJCHEM_Volume 67_Issue 4_Pages 193-206.pdf

PDF . 1.5MB

Link

https://ejchem.journals.ekb.eg/article_320070.html

Detail API

https://ejchem.journals.ekb.eg/service?article_code=320070

Order

320,070

Type

Original Article

Type Code

297

Publication Type

Journal

Publication Title

Egyptian Journal of Chemistry

Publication Link

https://ejchem.journals.ekb.eg/

MainTitle

Study, Docking, In Silico ADME and Bio-Evaluation of Novel Hetero-Aromatic Amino Acid Derivatives as Potential Anti-Epileptic Agents

Details

Type

Article

Created At

30 Dec 2024