Potentiometric, thermodynamics, and modeling investigates of binary and ternary Zn(II) complexes prepared from 1-H-benzimidazole-2-carboxylic acid and some biologically active ligands DOI

Aml M. Asran,

M.S.A. Mansour, Ayman A. Fayek

et al.

Inorganica Chimica Acta, Journal Year: 2024, Volume and Issue: unknown, P. 122473 - 122473

Published: Dec. 1, 2024

Language: Английский

Effect of central metal ion on some pharmacological properties of new Schiff base complexes. Anticancer, antioxidant, kinetic/thermodynamic and computational studies DOI

Alireza Oveisi Keikha,

Somaye Shahraki, Effat Dehghanian

et al.

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy, Journal Year: 2024, Volume and Issue: 325, P. 125034 - 125034

Published: Aug. 25, 2024

Language: Английский

Citations

13
Diacetyl Monoxime‐Based N∩N Donor Schiff Base and Its Zn(II) Complexes. In Vitro and In Silico Analysis DOI

Faezeh Shahriari,

Somaye Shahraki, Effat Dehghanian

et al.

Applied Organometallic Chemistry, Journal Year: 2024, Volume and Issue: 39(1)

Published: Oct. 3, 2024

ABSTRACT Schiff bases are introduced as versatile pharmacophores for the design and development of various bioactive compounds. Oxime‐based base ligands form an important flexible class that have attracted attention due to their wide applications in fields. Here, novel 3‐(2‐hydroxyphenyl‐imino)butan‐2‐one oxime, ( HPIO ) Zn(II) complexes derived from it, [Zn(bpy)(HPIO)](NO 3 2 , C1 (bpy = 2,2′‐bipyridine) [Zn(HPIO) ]Cl C2 were synthesized characterized. Theoretical studies showed both reactive high pharmacological affinity. Experimental investigations done compare some biological properties complexes. Antioxidant using ·DPPH (2,2‐diphenyl‐1‐picrylhydrazyl) assay presented following trend: > . Considering importance antioxidant enzyme catalase removing oxygen species (ROS), binding process / with was evaluated. Kinetic can inhibit catalytic performance by mixed‐type inhibition mechanism. The quenched fluorescence emission static quenching affinity higher than K b 1.51 0.89 × 10 5 M −1 respectively at 305 K). In interaction catalase, which exothermic spontaneous process, hydrogen bonds, van der Waals forces, hydrophobic interactions played a decisive role strongly confirmed molecular docking data. Tracking structural changes undergoes presence

Language: Английский

Citations

4
Elucidating the physicochemical interactions between fibrinogen and surfactant mixtures: Implications for pharmaceutical sciences DOI Creative Commons
Ramón Rial, Michael González‐Durruthy, Juan M. Ruso

et al.

International Journal of Biological Macromolecules, Journal Year: 2025, Volume and Issue: 299, P. 140265 - 140265

Published: Jan. 23, 2025

Language: Английский

Citations

0
Binding Mechanism Between Iron‐Related Proteins (Catalase and Transferrin) and Favipiravir DOI
Somaye Shahraki, Fereshteh Shiri, Razieh Nejat

et al.

ChemistrySelect, Journal Year: 2025, Volume and Issue: 10(7)

Published: Feb. 1, 2025

Abstract The study of protein‐drug interactions has become important in describing drug properties. Favipiravir ( Fav ) is an RNA polymerase inhibitor used to treat a wide range influenza viruses. This drug, which taken orally, can be quickly and widely absorbed the body. Here, interaction with two Fe‐related proteins, Catalase (CAT) Transferrin (TF), was investigated by spectroscopic molecular docking methods. results showed that strongly interact Fe‐proteins quench their intrinsic fluorescence through static mechanism. affinity CAT TF almost close each other order 10 6 M −1 K b = 9.54 × for ‐TF 10.71 ‐CAT at 310 K). binding proteins changed conformation some extent stability decreased. Molecular best site on both along types involved. Hydrogen bonds van der Waals were predominant forces observed between proteins. Accessible surface area supports successful CAT.

Language: Английский

Citations

0
Construction of Zn (II)/Mn (II) complexes based carboxylic acid ligands and their drug delivery, antiproliferation and DNA interaction DOI
Duo Li, Siying Chong, Shuangyan Wu

et al.

Journal of Molecular Liquids, Journal Year: 2025, Volume and Issue: unknown, P. 127187 - 127187

Published: Feb. 1, 2025

Language: Английский

Citations

0
Evaluation of anticancer capacity, catalase interactions, molecular docking, and antioxidant studies of some diamagnetic (Pd, Pt, and Zn) Schiff base complexes DOI
Somaye Shahraki, Effat Dehghanian,

Kobra Shahraki

et al.

Inorganica Chimica Acta, Journal Year: 2025, Volume and Issue: unknown, P. 122642 - 122642

Published: March 1, 2025

Language: Английский

Citations

0
Recent development of luminescent chemosensors for the recognition of nitroexplosives based on zinc(II) Schiff base complexes DOI
Subrata Jana, Shouvik Chattopadhyay

Inorganica Chimica Acta, Journal Year: 2024, Volume and Issue: 571, P. 122232 - 122232

Published: July 4, 2024

Language: Английский

Citations

2
Exploring dimethoxy naphthalenyl methoxyphenyl quinazolinyl amine as a PDE10A inhibitor: In-silico studies, synthesis and binding interactions with serum albumin DOI
Akanksha Mishra,

Pooja Pooja,

Chandraprakash Gond

et al.

Journal of Molecular Liquids, Journal Year: 2024, Volume and Issue: 412, P. 125788 - 125788

Published: Aug. 28, 2024

Language: Английский

Citations

2
Synthesis, characterization and catalytic evaluation of three new Pd-iminophosphine complexes on Suzuki cross-coupling reactions DOI

Özle Özay,

Hakan Ünver

Journal of Chemical Sciences, Journal Year: 2024, Volume and Issue: 136(3)

Published: June 14, 2024

Language: Английский

Citations

1
Metal complexes containing vitamin B6-based scaffold as potential DNA/BSA-binding agents inducing apoptosis in hepatocarcinoma (HepG2) cells DOI

Almuhrah A. N. Alroba,

Elham S. Aazam, Mehvash Zaki

et al.

Molecular Diversity, Journal Year: 2024, Volume and Issue: unknown

Published: Sept. 18, 2024

Language: Английский

Citations

1