Novel pyrimidine derivatives as potential anticancer agents: Synthesis, biological evaluation and molecular docking study

B Tylińska, B Wiatrak, Ż Czyżnikowska… - … journal of molecular …, 2021 - mdpi.com
Molecular Docking We performed a molecular docking study to determine the binding mode
of … The docking protocol was validated by docking the co-crystalized ligand etoposide to the …

Design, synthesis, molecular docking and anticancer evaluations of 5-benzylidenethiazolidine-2, 4-dione derivatives targeting VEGFR-2 enzyme

K El-Adl, AGA El-Helby, H Sakr, IH Eissa… - Bioorganic …, 2020 - Elsevier
… , synthesized and evaluated for anticancer activity … evaluated for their inhibitory activities
against VEGFR-2. The elongation of the structures to have distal moieties enhanced anticancer

Design, synthesis, biological evaluation and molecular docking studies of novel benzofuran–pyrazole derivatives as anticancer agents

SS Abd El-Karim, MM Anwar, NA Mohamed, T Nasr… - Bioorganic …, 2015 - Elsevier
… , the inhibitory activity was evaluated against c-Src at Kinexus Corporation. Molecular docking
studies were carried out to explain how these compounds could act at the molecular level. …

Synthesis, anticancer evaluation, and molecular docking studies of thiazolyl-pyrazoline derivatives

NH Nasab, F Azimian, YS Eom, FH Shah… - Bioorganic & Medicinal …, 2023 - Elsevier
anticancer compounds. This study presents the synthesis of eleven new thiazolyl-pyrazoline
derivatives (7a-k) and the evaluation of … Molecular docking studies were carried out to show …

Hybridized quinoline derivatives as anticancer agents: design, synthesis, biological evaluation and molecular docking

MR Selim, MA Zahran, A Belal… - Anti-Cancer Agents …, 2019 - ingentaconnect.com
… in the new molecular design (Fig. 1) would lead to better anticancer agents. Furthermore, the
… in this research work in addition to molecular docking studies to give a clear explanation for …

Design, synthesis, molecular docking, and anticancer evaluations of 1‐benzylquinazoline‐2,4(1H,3H)‐dione bearing different moieties as VEGFR‐2 inhibitors

K El‐Adl, AGA El‐Helby, H Sakr… - Archiv der …, 2020 - Wiley Online Library
… , synthesized, and evaluated for their anticancer activity against … Furthermore, molecular
docking studies were performed for … , and evaluated for their anticancer activity against three …

Design, synthesis, in vitro anticancer and antimicrobial evaluation, SAR analysis, molecular docking and dynamic simulation of new pyrazoles, triazoles and …

HA Radwan, I Ahmad, IMM Othman… - Journal of Molecular …, 2022 - Elsevier
Molecular docking studies on the intriguing … docking scores. Furthermore, the dynamic
nature, binding interaction, and protein–ligand stability were explored through molecular

Design, green synthesis, molecular docking and anticancer evaluations of diazepam bearing sulfonamide moieties as VEGFR-2 inhibitors

NM Saleh, MSA El-Gaby, K El‐Adl… - Bioorganic …, 2020 - Elsevier
… , synthesized and evaluated for anticancer activity against HepG2, … All the synthesized
compounds 5 af and 7 ac were evaluated for … The data obtained from docking studies were highly …

Design, synthesis, molecular docking, anticancer evaluations, and in silico pharmacokinetic studies of novel 5‐[(4‐chloro/2, 4‐dichloro) benzylidene] thiazolidine‐2, 4 …

K El‐Adl, AGA El‐Helby, H Sakr, RR Ayyad… - Archiv der …, 2021 - Wiley Online Library
… The anticancer activity of novel thiazolidine‐2,4‐diones was evaluated against HepG2,
HCT‐116… All the synthesized derivatives 7–18 were evaluated for their inhibitory activities against …

QSAR modeling, molecular docking and cytotoxic evaluation for novel oxidovanadium (IV) complexes as colon anticancer agents

FY Alomari, AA Sharfalddin, MH Abdellattif, D Domyati… - Molecules, 2022 - mdpi.com
molecule may accept (ΔN max ) showed the practical biological potency of [VO(CTZ) 2 ] 2H
2 O. The complexes were also evaluated … Furthermore, molecular docking was carried out to …