An outlook of docking analysis and structure-activity relationship of pyrimidine-based analogues as EGFR inhibitors against non-small cell lung cancer (NSCLC)

R Pal, G Teli, S Sengupta, L Maji… - Journal of …, 2024 - Taylor & Francis
Almost 80% of lung cancer diagnoses each year correspond to non-small cell lung cancer
(NSCLC). The percentage of NSCLC with EGFR overexpression ranges from 40% to 89 …

Advances in synthesis and biological evaluation of CDK2 inhibitors for cancer therapy

DA Patel, SS Patel, HD Patel - Bioorganic Chemistry, 2024 - Elsevier
One of the leading causes of mortality in the world is cancer. This disease occurs when
responsible genes that regulate the cell cycle become inactive due to internal or external …

Ligand-based design on the dog-bone-shaped BIBR1532 pharmacophoric features and synthesis of novel analogues as promising telomerase inhibitors with in vitro …

AA Al-Karmalawy, MS Nafie, MA Shaldam… - Journal of Medicinal …, 2022 - ACS Publications
Telomerase is an outstanding biological target for cancer treatment. BIBR1532 is a non-
nucleoside selective telomerase inhibitor; however, it experiences ineligible …

The Assessment of Anticancer and VEGFR-2 Inhibitory Activities of a New 1H-Indole Derivative: In Silico and In Vitro Approaches

EB Elkaeed, RG Yousef, H Elkady, IMM Gobaara… - Processes, 2022 - mdpi.com
Corresponding to the reported features of anti-VEGFR-2-approved compounds, a new 1 H-
indole derivative (compound 7) was designed. The inhibitory potential of the designed …

Modified benzoxazole-based VEGFR-2 inhibitors and apoptosis inducers: Design, synthesis, and anti-proliferative evaluation

A Elwan, AE Abdallah, HA Mahdy, MA Dahab… - Molecules, 2022 - mdpi.com
This work is one of our efforts to discover potent anticancer agents. We modified the most
promising derivative of our previous work concerned with the development of VEGFR-2 …

New Anticancer Theobromine Derivative Targeting EGFRWT and EGFRT790M: Design, Semi-Synthesis, In Silico, and In Vitro Anticancer Studies

EB Elkaeed, RG Yousef, H Elkady, AA Alsfouk… - Molecules, 2022 - mdpi.com
Based on the pharmacophoric features of EGFR inhibitors, a new semisynthetic
theobromine-derived compound was designed to interact with the catalytic pocket of EGFR …

Synthesis, biological evaluation and computer-aided discovery of new thiazolidine-2, 4-dione derivatives as potential antitumor VEGFR-2 inhibitors

H Elkady, OA El-Dardir, A Elwan, MS Taghour… - RSC …, 2023 - pubs.rsc.org
In this study, novel VEGFR-2-targeting thiazolidine-2, 4-dione derivatives with potential
anticancer properties were designed and synthesized. The ability of the designed …

Design, semi-synthesis, anti-cancer assessment, docking, MD simulation, and DFT studies of novel theobromine-based derivatives as VEGFR-2 inhibitors and …

IH Eissa, RG Yousef, H Elkady, EB Elkaeed… - … Biology and Chemistry, 2023 - Elsevier
A group of theobromine derivatives was designed based on the key pharmacophoric
characteristics of VEGFR-2 inhibitors. HepG2 and MCF-7 cancer cell lines were used to test …

Discovery of new VEGFR-2 inhibitors and apoptosis inducer-based thieno[2,3-d]pyrimidine

SA El-Metwally, H Elkady, M Hagras… - Future Medicinal …, 2023 - Taylor & Francis
Background: VEGFR-2 is a key regulator of cancer cell proliferation, migration and
angiogenesis. Aim: Development of thieno [2, 3-d] pyrimidine derivatives as potential anti …