[HTML][HTML] Structural insights into conformational stability and binding of thiazolo-[2, 3-b] quinazolinone derivatives with EGFR-TKD and in-vitro study

SA Mir, PP Mohanta, RK Meher, MK Raval… - Saudi Journal of …, 2022 - Elsevier
… However, the approved drugs against EGFR-TKD showed adverse toxicities effects such
as … -[2,3-b] quinazolinone derivatives with the therapeutic target (EGFR-TKD) via molecular …

[HTML][HTML] Molecular dynamic simulation, free binding energy calculation of Thiazolo-[2, 3-b] quinazolinone derivatives against EGFR-TKD and their anticancer activity

SA Mir, RK Meher, I Baitharu, B Nayak - Results in Chemistry, 2022 - Elsevier
… ,3-b] quinazolinone derivatives were found to be similar with other reported drug EGFR-TKD
In the present studies, the series of novel thiazolo-[2,3-b] quinazolinones were synthesized …

In silico and in vitro evaluations of fluorophoric thiazolo-[2, 3-b] quinazolinones as anti-cancer agents targeting EGFR-TKD

SA Mir, GC Dash, RK Meher, PP Mohanta… - Applied Biochemistry …, 2022 - Springer
… Remarkably, benzothiazole-[2,3-b]quinazolinone frameworks display in vitro cytotoxicity
and inhibitory potency towards EGFR [16, 17]. Synthesized 4(3H)-quinazolinone derivative

[PDF][PDF] … Dynamic Simulations and Binding Free Energy Evaluations of Thiazolo-[2, 3-b] Quinazolinone Derivatives With wtEGFR-TKD and" TMLR" Mutant EGFR-TKD

S Mir, B Nayak - 2021 - academia.edu
… Overall, mutations by nonspeci c drugs towards EGFR-TKD … demonstrated that quinazolinones
are EGFR-TKD inhibitors, … -b] quinazolinones could be used as an EGFR-TKD inhibitor In …

… binding stability of hydroxy-3-(4-hydroxyphenyl)-5-(4-nitrophenyl)-5, 5a, 7, 8, 9, 9a-hexahydrothiazolo [2, 3-b] quinazolin-6-one with T790M/L858R EGFR-TKD

SA Mir, B Nayak - Journal of Biomolecular Structure and Dynamics, 2023 - Taylor & Francis
EGFR-TKD bound thiazolo-[2,3-b] quinazolinone derivative … The TMLR mutated EGFR-TKD
bound synthesised molecule … ] quinazolinone derivatives against TMLR mutant EGFR-TKD

Novel oxazolo [4, 5-g] quinazolin-2 (1H)-ones: dual inhibitors of EGFR and Src protein tyrosine kinases

J Lin, W Shen, J Xue, J Sun, X Zhang… - European journal of …, 2012 - Elsevier
Quinazoline-containing derivatives are an important class of synthetic products and represent
an attractive scaffold for EGFR … tyrosine kinase domain (TKD) and block activity which don’t …

Identification and exploration of quinazoline-1, 2, 3-triazole inhibitors targeting EGFR in lung cancer

S Kumar, S Sengupta, I Ali, MK Gupta… - Journal of …, 2023 - Taylor & Francis
quinazoline hybrid compounds were designed by Chemdraw software and docked against
five different crystallographic EGFR tyrosine kinase domain (TKD). … Quinazoline derivatives

Bioinspired thiazolo-[2,3-b] quinazolin-6-one derivatives as potent anti-cancer agents targeting EGFR: their biological evaluations and in silico assessment

SA Mir, PP Mohanta, RK Meher, I Baitharu… - Molecular Diversity, 2023 - Springer
EGFR pathways, thus, inhibiting downstream signaling cascades [21, 22]. The novel
quinazolinone derivatives inhibit EGFR … Targeting EGFR-TKD has turned into an attractive target …

Molecular modeling, dynamic simulation, and metabolic reactivity studies of quinazoline derivatives to investigate their anti-angiogenic potential by targeting wild …

AA Shah, N Kumar… - Journal of …, 2023 - Taylor & Francis
… Similarly, when subjecting the same set of 74 quinazoline derivatives to multi-ligand
docking against the active site of mutant EGFR T 790M (3IKA), we identified 16 potential …

[HTML][HTML] Design, synthesis, in-silico studies and apoptotic activity of novel amide enriched 2-(1H)-quinazolinone derivatives

N Gariganti, A Bandi, KRSN Gatta, J Pagag… - Heliyon, 2024 - cell.com
… Molecular docking studies of test compounds (7a-j) with the EGFR tyrosine kinase domain
(PDB ID: 1M17) protein provided the significant docking scores for each test compound (7a-j) (…