Article Per Year (5 Year)
p-Index From 2021 - 2026
0.23
P-Index
This Author published in this journals
All Journal Benzena Pharmaceutical Scientific Journal
Sal Sabila Nadhifah Kurochman
Fakultas Farmasi Universitas Muhammadiyah Purwokerto
Biochemistry, Genetics & Molecular Biology Chemical Engineering, Chemistry & Bioengineering Immunology & microbiology Medicine & Pharmacology Public Health

Published : 1 Documents Claim Missing Document
Claim Missing Document
Check
Articles

Found 1 Documents
Search

 1 
Studi In Silico Clitoria ternatea L terhadap Protein NF-K, TNF-, IFNβ, IL-6 dan IFN- sebagai Kandidat Imunomodulator Uqie Shabrina Hasyyati; Sal Sabila Nadhifah Kurochman; Monika Wisda Herisman; Elza Sundhan
BENZENA Pharmaceutical Scientific Journal Vol 5 No 01 (2026): BENZENA PHARMACEUTICAL SCIENTIFIC JOURNAL
Publisher : Universitas Pekalongan

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.31941/benzena.v5i01.8102

Abstract

Introduction: Understanding the mechanisms of action of natural compounds as immunomodulators is important for the prevention and treatment of infections. Objective: Secondary metabolites from Clitoria ternatea L. with potential as immunomodulators were identified through affinity screening of proteins involved in immune system regulation and ADME prediction. Methods: Molecular docking was performed using the Molecular Operating Environment (MOE®), and ADME prediction was conducted using SwissADME. Results: The docking results showed that the proteins IFNβ (1AU1), IL-6 (1ALU), NF-κB (3QXY), TNF-Alpha (2AZ5 & 6X85), and IFN-alpha (3SE3) had RMSD values < 2 Å and were selected as PDB IDs. The three potential compounds from butterfly pea flowers were able to bind to the 3QXY protein through the amino acids ASP248; TYR223; ASN251 (Quercetin-3-rutinoside), GLU154; ALA222 (-(-)-Epicatechin) and LEU146 (Delphinidin-3-O-glucoside). Compounds from butterfly pea flowers that can bind to NF-κB target proteins (PDB ID: 3QXY) are more potent than the natural ligands, namely quercetin-3-rutinoside, (-)-epicatechin, and delphinidin-3-O-glucoside. ADME prediction results showed good lipophilicity with a log P value <5, but low gastrointestinal absorption. Conclusion: Secondary metabolites from butterfly pea flowers have the potential to be developed as immunomodulatory candidates due to their relatively good affinity.
Co-Authors Elza Sundhan Monika Wisda Herisman Uqie Shabrina Hasyyati