Discovery of novel pyrrolo[2,3-d]pyrimidine derivatives as anticancer agents: virtual screening and molecular dynamic studies DOI
Sunny Dhiman, Swati Gupta, Sushil K. Kashaw

и другие.

SAR and QSAR in environmental research, Год журнала: 2024, Номер unknown, С. 1 - 33

Опубликована: Ноя. 28, 2024

CDK/Cyclins are dysregulated in several human cancers. Recent studies showed inhibition of CDK4/6 was responsible for controlling cell cycle progression and cancer growth. In the present study, atom-based field-based 3D-QSAR, virtual screening, molecular docking dynamics were done development novel pyrrolo[2,3-d]pyrimidine (P2P) derivatives as anticancer agents. The developed models good

Язык: Английский

Design, Synthesis and Biological Evaluation of Novel 9H Purine Derivatives as Potent CDK9 Inhibitors DOI Open Access
Chunlei Tang, Dong Wang, Huabing Wang

и другие.

Chemical Biology & Drug Design, Год журнала: 2025, Номер 105(2)

Опубликована: Янв. 30, 2025

ABSTRACT Cyclin‐dependent kinase 9 (CDK9) is considered as an important target in the research of antitumor drugs. Taking CDK2/9 inhibitor CYC065 positive control and in‐house library compound ( 64 ) lead compound, four classes 22 compounds with 9H purine core structure were designed to establish structure–activity relationships (SAR). In general, SAR CDK9 inhibitors systematically described this paper, resulting discovery two B2 B5 further value. After conducting selectivity testing against kinase, demonstrated approximately five‐fold greater towards CDK9‐cyclinT1 over CDK2‐cyclinE2. This work also provides a reference basis for subsequent on inhibitors.

Язык: Английский

Процитировано

1

Advances in the Design, Discovery, and optimization of aurora kinase inhibitors as anticancer agents DOI
Anita Verma,

Pradhuman Bharatiya,

Aashish Jaitak

и другие.

Expert Opinion on Drug Discovery, Год журнала: 2025, Номер unknown

Опубликована: Март 17, 2025

Introduction Aurora kinases (AKs) play key roles during carcinogenesis and show a close relationship with many cellular effects including mitotic entry, spindle assembly chromosomal alignment biorientation. Indeed, elevated levels of AKs have been reported in several different tumor types, leading research scientists to investigate ways that we can target for the purpose developing new anticancer therapeutics.

Язык: Английский

Процитировано

0

Drug repurposing of cyclin-dependent kinase inhibitors for neutrophilic acute respiratory distress syndrome and psoriasis DOI Creative Commons
Shun‐Hua Chen, Chun‐Hong Chen, Hsin-Chieh Lin

и другие.

Journal of Advanced Research, Год журнала: 2024, Номер unknown

Опубликована: Июль 1, 2024

Neutrophilic inflammation, characterized by dysregulated neutrophil activation, triggers a variety of inflammatory responses such as chemotactic infiltration, oxidative bursts, degranulation, extracellular traps (NETs) formation, and delayed turnover. This type inflammation is pivotal in the pathogenesis acute respiratory distress syndrome (ARDS) psoriasis. Despite current treatments, managing neutrophil-associated symptoms remains significant challenge. review emphasizes role cyclin-dependent kinases (CDKs) activation inflammation. It aims to highlight therapeutic potential repurposing CDK inhibitors manage neutrophilic particularly ARDS Additionally, it discusses necessary precautions for clinical application these due off-target effects need dose optimization. CDKs regulate key functions, including responses, NET apoptosis. Repurposing inhibitors, originally developed cancer treatment, shows promise controlling Clinical anticancer drugs, palbociclib ribociclib, have demonstrated efficacy treating psoriasis targeting off-label pathways, phosphoinositide 3-kinase (PI3K) phosphodiesterase 4 (PDE4), respectively. While offer promising benefits, their requires careful consideration Further exploration trials are ensure safety conditions.

Язык: Английский

Процитировано

3

Advances in Cancer Therapy: A Comprehensive Review of CDK and EGFR Inhibitors DOI Creative Commons
Mohammed Hawash

Cells, Год журнала: 2024, Номер 13(19), С. 1656 - 1656

Опубликована: Окт. 6, 2024

Protein kinases have essential responsibilities in controlling several cellular processes, and their abnormal regulation is strongly related to the development of cancer. The implementation protein kinase inhibitors has significantly transformed cancer therapy by modifying treatment strategies. These received substantial FDA clearance recent decades. emerged as primary objectives for therapeutic interventions, particularly context treatment. At present, 69 therapeutics been approved that target approximately 24 kinases, which are specifically prescribed neoplastic illnesses. novel agents inhibit certain such receptor protein-tyrosine protein-serine/threonine dual-specificity nonreceptor kinases. This review presents a comprehensive overview targets inhibitors, with specific focus on cyclin-dependent (CDKs) epidermal growth factor (EGFR). majority reviewed studies commenced an assessment cell lines concluded biological evaluation individual targets. articles provide detailed information structural features potent anticancer activity, refers ability selectively cancer-promoting including CDKs EGFR. Additionally, latest FDA-approved targeting these enzymes were highlighted accordingly.

Язык: Английский

Процитировано

3

Discovery of novel pyrrolo[2,3-d]pyrimidine derivatives as anticancer agents: virtual screening and molecular dynamic studies DOI
Sunny Dhiman, Swati Gupta, Sushil K. Kashaw

и другие.

SAR and QSAR in environmental research, Год журнала: 2024, Номер unknown, С. 1 - 33

Опубликована: Ноя. 28, 2024

CDK/Cyclins are dysregulated in several human cancers. Recent studies showed inhibition of CDK4/6 was responsible for controlling cell cycle progression and cancer growth. In the present study, atom-based field-based 3D-QSAR, virtual screening, molecular docking dynamics were done development novel pyrrolo[2,3-d]pyrimidine (P2P) derivatives as anticancer agents. The developed models good

Язык: Английский

Процитировано

0