Irreversible protein kinase inhibitors: balancing the benefits and risks

T Barf, A Kaptein - Journal of medicinal chemistry, 2012 - ACS Publications
In the relatively young but expanding field of irreversible kinase inhibitor drug discovery,
there are two main developments that are of central importance. First, the patients have …

Thieno [2, 3-d] pyrimidine as a promising scaffold in medicinal chemistry: Recent advances

EMH Ali, MS Abdel-Maksoud, CH Oh - Bioorganic & medicinal chemistry, 2019 - Elsevier
Thienopyrimidine scaffold is a fused heterocyclic ring system that structurally can be
considered as adenine, the purine base that is found in both DNA and RNA-bioisosteres …

Discovery of thieno [2, 3-d] pyrimidine-based derivatives as potent VEGFR-2 kinase inhibitors and anti-cancer agents

SA El-Metwally, MM Abou-El-Regal, IH Eissa… - Bioorganic …, 2021 - Elsevier
Vascular endothelial growth factor-2 (VEGFR-2) is considered one of the most important
factors in tumor angiogenesis, and consequently a number of anticancer therapeutics have …

Design, synthesis and anticancer evaluation of thieno [2, 3-d] pyrimidine derivatives as dual EGFR/HER2 inhibitors and apoptosis inducers

SA Elmetwally, KF Saied, IH Eissa, EB Elkaeed - Bioorganic chemistry, 2019 - Elsevier
Deregulation of many kinases is directly linked to cancer development and the tyrosine
kinase family is one of the most important targets in current cancer therapy regimens. In this …

Novel 4-(2-arylidenehydrazineyl) thienopyrimidine derivatives as anticancer EGFR inhibitors: Design, synthesis, biological evaluation, kinome selectivity and in silico …

HA Elsebaie, EA El-Bastawissy, KM Elberembally… - Bioorganic …, 2023 - Elsevier
The current study discovered fifteen new thieno [2, 3-d] pyrimidine derivatives with potential
anticancer action, including 5a-l, 6, and 7a-b. Results from the NCI screening revealed that …

Comparative study between deep learning and QSAR classifications for TNBC inhibitors and novel GPCR agonist discovery

LK Tsou, SH Yeh, SH Ueng, CP Chang, JS Song… - Scientific reports, 2020 - nature.com
Abstract Machine learning is a well-known approach for virtual screening. Recently, deep
learning, a machine learning algorithm in artificial neural networks, has been applied to the …

Design, synthesis and cytotoxic evaluation of new thieno [2, 3-d] pyrimidine analogues as VEGFR-2/AKT dual inhibitors, apoptosis and autophagy inducers

HK Abd El-Mawgoud, AM AboulMagd, MTM Nemr… - Bioorganic …, 2024 - Elsevier
Abstract Novel thieno [2, 3-d] pyrimidine analogues were designed, synthesized and
evaluated for anti-proliferative activity against HepG-2, PC-3 and MCF-7 cancer cell lines. In …

Structure-based virtual screening approach for discovery of covalently bound ligands

D Toledo Warshaviak, G Golan… - Journal of chemical …, 2014 - ACS Publications
We present a fast and effective covalent docking approach suitable for large-scale virtual
screening (VS). We applied this method to four targets (HCV NS3 protease, Cathepsin K …

Recent updates on thienopyrimidine derivatives as anticancer agents

MTM Sayed, RA Hassan, PA Halim… - Medicinal Chemistry …, 2023 - Springer
Thienopyrimidine derivatives hold a unique place between fused pyrimidine compounds.
They are important and widely represented in medicinal chemistry as they are structural …

Discovery of New Apoptosis-Inducing Agents for Breast Cancer Based on Ethyl 2-Amino-4,5,6,7-Tetra Hydrobenzo[b]Thiophene-3-Carboxylate: Synthesis, In Vitro …

EM Gad, MS Nafie, EH Eltamany, MSAG Hammad… - Molecules, 2020 - mdpi.com
A multicomponent synthesis was empolyed for the synthesis of ethyl 2-amino-4, 5, 6, 7-
tetrahydrobenzo [b] thiophene-3-carboxylate 1. An interesting cyclization was obtained …