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In silico Methods for Design of Kinase Inhibitors as Anticancer Drugs
Rational drug design implies usage of molecular modeling techniques such as
pharmacophore modeling, molecular dynamics, virtual screening, and molecular docking to …
pharmacophore modeling, molecular dynamics, virtual screening, and molecular docking to …
Topical advances in PIM kinases and their inhibitors: Medicinal chemistry perspectives
Cytosolic PIM kinases are the members of serine/threonine family play a crucial role in the
cancer progression and development. Overexpression of PIM kinases is observed in various …
cancer progression and development. Overexpression of PIM kinases is observed in various …
Design, synthesis, antineoplastic activity of new pyrazolo [3, 4-d] pyrimidine derivatives as dual CDK2/GSK3β kinase inhibitors; molecular docking study, and ADME …
In the current study, novel pyrazolo [3, 4-d] pyrimidine derivatives 5a–h were designed and
synthesized as targeted anti-cancer agents through dual CDK2/GSK-3β inhibition. The …
synthesized as targeted anti-cancer agents through dual CDK2/GSK-3β inhibition. The …
Tailored horseshoe-shaped nicotinonitrile scaffold as dual promising c-Met and Pim-1 inhibitors: Design, synthesis, SAR and in silico study
For the horseshoe tactic to succeed in inhibiting c-Met and Pim-1, the nicotinonitrile
derivatives (2a-n) were produced in high quantities by coupling acetyl phenylpyrazole (1) …
derivatives (2a-n) were produced in high quantities by coupling acetyl phenylpyrazole (1) …
New thiophene, thienopyridine and thiazoline-based derivatives: Design, synthesis and biological evaluation as antiproliferative agents and multitargeting kinase …
ZM Alamshany, NY Tashkandi, IMM Othman… - Bioorganic …, 2022 - Elsevier
Multitargeting kinase inhibitors recently proved to be a profitable approach for conquering
cancer proliferation. The current study represents the design and synthesis of new …
cancer proliferation. The current study represents the design and synthesis of new …
A decade's overview of 2‐aminothiophenes and their fused analogs as promising anticancer agents
DG Darwish, HAM El‐Sherief… - Archiv der …, 2024 - Wiley Online Library
Over the past decades, cancer has been a challenging domain for medicinal chemists as it
is an international health concern. In association, small molecules such as 2 …
is an international health concern. In association, small molecules such as 2 …
Design, synthesis, anticancer evaluation, and in silico studies of some thieno[2,3‐d]pyrimidine derivatives as EGFR inhibitors
Abstract New series of 20 thieno [2, 3‐d] pyrimidine derivatives have been synthesized. The
National Cancer Institute evaluated all the newly synthesized compounds for their …
National Cancer Institute evaluated all the newly synthesized compounds for their …
Design, synthesis, anticancer evaluation and molecular modeling of novel estrogen derivatives
A series of estrone derivatives 3–8 was designed and synthesized using estrone
arylmethylenes 2a, b as starting materials and their structures were confirmed by different …
arylmethylenes 2a, b as starting materials and their structures were confirmed by different …
Development of new steroid-based hydrazide and (thio) semicarbazone compounds with anticancer properties
ÐD Janković, TL Šestić, SS Bekić, MP Savić… - The Journal of Steroid …, 2024 - Elsevier
Most breast and prostate cancers are caused by abnormal production or action of steroidal
hormones. Hormonal drugs based on steroid scaffolds represent a significant class of …
hormones. Hormonal drugs based on steroid scaffolds represent a significant class of …
Design and synthesis of a novel mitochondria-targeted osteosarcoma theranostic agent based on a PIM1 kinase inhibitor
X Yi, Z Cao, Y Yuan, W Li, X Cui, Z Chen, X Hu… - Journal of Controlled …, 2021 - Elsevier
Osteosarcoma (OS) is the most common malignancy of the skeletal system, with a poor
prognosis and high rate of recurrence. Adequate surgical margin and adjuvant …
prognosis and high rate of recurrence. Adequate surgical margin and adjuvant …