Innovational combination of hetero-bifunctional N-PEG quinoline scaffolds derivatives with improved anticancer activity against breast and colon cancer cell lines and P-glycoprotein, cytochrome p450 enzyme activity prediction

Abstract

Polyethylene glycol (PEG) is a polymer that is widely used as a carrier for drug delivery systems (DDS). A library of N-PEGylated quinoline derivatives of PEG molecular weight 200 was prepared rapidly after the activation of PEGs using maleic anhydride. Quinoline with a polymer backbone is essential as new material. PEG is a water-soluble nonionic polymer approved by food and drug organizations for medicine applications. Because of its nontoxic grapheme, it is widely utilized in numerous biochemical, cosmetic, pharmaceutical, and industrialized applications. The modern SwissADME is a web tool that stretches free admittance to a pool of hasty, yet solid, clarifying models for physicochemical properties, pharmacokinetics, and therapeutic science. The present facile synthetic strategy can be a practical approach for incorporating polymeric carriers conjugated with drug moieties, either in the backbone of the polymer or as a terminal and pendant group on the polymer chains.

Synthesis, Crystal Structure, Hirshfeld Surface Analysis, and Computational Approach of a New Pyrazolo[3,4-g]isoquinoline Derivative as Potent against Leucine-Rich Repeat Kinase 2 (LRRK2)

“…The absorption potential in the human intestine (HIA) was also explored, considering calculated values for lipophilicity (WlogP) and polarity (TPSA). 65 This comprehensive analysis provided valuable insights into the pharmacokinetic and toxicological profiles of 5 , aiding in understanding its potential effects within the body.…”

“…In addition to standard ADME properties, the “Brain or Intestinal Predicted Permeation” (BOILED-Egg) method was used to predict its potential to enter the central nervous system (CNS) and to determine whether 5 served as a substrate for P -glycoprotein (Pgp), a vital transporter influencing drug absorption and efflux. The absorption potential in the human intestine (HIA) was also explored, considering calculated values for lipophilicity (WlogP) and polarity (TPSA) . This comprehensive analysis provided valuable insights into the pharmacokinetic and toxicological profiles of 5 , aiding in understanding its potential effects within the body.…”

Anti-Cancer Activity of Gabapentin and Chiral Amino Acids-Based Hybrid-Peptides against MCF-7 Breast Cancer Cell-Line

“…The reaction was monitored by TLC using mobile phase Dichloromethane and methanol (9:1). It was distilled off under reduced pressure and washed twice with hexane with vigorous stirring to afford the product (6) and was found white hygroscopic solid material.…”

“…The worldwide new cases of female breast cancer are estimated to reach nearly 3.2 million per year by 2050 [3][4][5]. Despite the intensive investigation of breast cancer cell lines, the cellular and molecular mechanisms between the MCF-7 cell line and the drug polyoxometalate (POM) are still limited [6]. Anticancer peptides (ACPs) have been proved to be effective small molecules (nearly 50 amino acids) that can act specifically against cancerous cells by either a membranolytic mechanism or disruption of mitochondria [7].…”