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178717

Design, Synthesis, Molecular Modeling and Biological Evaluation of Novel 1,5-Diarylpyrazole Carboxamide Derivatives as Antiproliferative Agents

Article

Last updated: 03 Jan 2025

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Subjects

-

Tags

Analytical and Medicinal Chemistry

Abstract

A series of new 1,5-diarylpyrazole carboxamide derivatives was designed and synthesized. All the synthesized compounds were biologically evaluated for their in vitro cytotoxic activities against a panel of five cancer cell lines namely, DLD, Hela, K-562, SUIT and HepG-2. The results revealed that compound 5c exhibited the most prominent cytotoxic effect against four tested cell lines with growth inhibition percentages ranged from 75.95 to 123 % and IC50 values of 17.20 and 21.20 μM comparable to that of daunorubicin as a control drug (IC50 values of 13.30 and 22 μM) against K-562 and Hep-G2 cell lines. Molecular docking study suggested the ability of the tested compounds to inhibit EGFR-TK. Data showed that 5c posses the ability to bind to erlotinib binding site forming a stable complex with energy scores -7.73 compared to -7.63 for erlotinib. It potentially forms three hydrogen bonds with LYS 721 and GLU 638 residues. Data suggests that compound 5c is a promising lead in the design of further EGFR inhibitors.

DOI

10.21608/jabps.2021.73962.1127

Keywords

Anticancer, 1, 5-diarylpyrazole derivatives, EGFR-TKI, Molecular docking

Authors

First Name

Mai

Last Name

Shoman

MiddleName

-

Affiliation

Faculty of Pharmacy, Minia University, Minia Egypt

Email

mai_shoman@mu.edu.eg

City

Minia

Orcid

0000-0001-6837-5093

First Name

osama

Last Name

soltan

MiddleName

-

Affiliation

Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Al-Azhar University, Assiut 71524, Egypt

Email

osama_soltan11@yahoo.com

City

-

Orcid

https://orcid.org/00

First Name

kieta

Last Name

Nagaoka

MiddleName

-

Affiliation

Department of Biological Engineering, Graduate School of Science and Engineering, Yamagata University, Jonan 4-3-16, Yonezawa 992-8510, Japan

Email

tmx98328@st.yamagata-u.ac.jp

City

-

Orcid

-

First Name

Salah

Last Name

Abdel-aziz

MiddleName

-

Affiliation

Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Al-Azhar University, 71524 Assiut, Egypt Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Deraya University, Minia 61111, Egypt

Email

salah72aa@yahoo.com

City

Assiut

Orcid

-

First Name

Atsushi

Last Name

Narumi

MiddleName

-

Affiliation

Department of Organic Materials Science, Graduate School of Organic Materials Science, Yamagata University, Jonan 4-3-16, Yonezawa 992-8510, Japan

Email

narumi@yz.yamagata-u.ac.jp

City

-

Orcid

https://orcid.org/00

First Name

Hiroyuki

Last Name

Konno

MiddleName

-

Affiliation

Department of Biological Engineering, Graduate School of Science and Engineering, Yamagata University, Jonan 4-3-16, Yonezawa 992-8510, Japan

Email

konno@yz.yamagata-u.ac.jp

City

-

Orcid

konno@yz.yamagata-u.

First Name

Mohamed

Last Name

Abdelaziz

MiddleName

-

Affiliation

Faculty of Pharmacy, Minia University, Minia Egypt

Email

abulnil@mu.edu.eg

City

Minia

Orcid

0000-0003-1396-8662

Volume

4

Article Issue

3

Related Issue

26219

Issue Date

2021-07-01

Receive Date

2021-04-26

Publish Date

2021-07-01

Page Start

152

Page End

159

Print ISSN

2535-1869

Online ISSN

2535-2040

Article File

JABPS_Volume 4_Issue 3_Pages 152-159.pdf

PDF . 768.0kB

Link

https://jabps.journals.ekb.eg/article_178717.html

Detail API

https://jabps.journals.ekb.eg/service?article_code=178717

Order

4

Type

Original Article

Type Code

522

Publication Type

Journal

Publication Title

Journal of advanced Biomedical and Pharmaceutical Sciences

Publication Link

https://jabps.journals.ekb.eg/

MainTitle

Design, Synthesis, Molecular Modeling and Biological Evaluation of Novel 1,5-Diarylpyrazole Carboxamide Derivatives as Antiproliferative Agents

Details

Type

Article

Created At

22 Jan 2023