Article Per Year (5 Year)
p-Index From 2019 - 2024
1.683
P-Index
This Author published in this journals
All Journal Teori dan Penelitian Pendidikan Dasar Jurnal Kimia Riset Health Care : Jurnal Kesehatan Jurnal Kesehatan STIKes IMC Bintaro JURNAL TALENTA PKM Linggau: Jurnal Pengabdian dan Pemberdayaan Masyarakat Jurnal Permata Indonesia Biology and Education Journal (BaEJ) Buana Informatika Dunia Keperawatan Jurnal Fokus Elektroda (Energi Listrik, Telekomunikasi, Komputer, Elektronika dan Kendali)
Herlina
Unknown Affiliation
Arts Humanities Chemistry Computer Science & IT Decision Sciences, Operations Research & Management Economics, Econometrics & Finance Education Electrical & Electronics Engineering Energy Engineering Health Professions Immunology & microbiology Languange, Linguistic, Communication & Media Medicine & Pharmacology Neuroscience Nursing Public Health Social Sciences Other

Published : 13 Documents Claim Missing Document
Claim Missing Document
Check
Articles

Found 1 Documents
Search
Journal : Jurnal%20Kimia%20Riset

 1 
STUDY IN SILICO OF THIOUREA-DERIVED COMPOUNDS AS TYROSINE KINASE RECEPTOR INHIBITORS Budi Mulyati; Sri Sutjiningtyas; Herlina
Jurnal Kimia Riset Vol. 7 No. 2 (2022): December
Publisher : Universitas Airlangga, Campus C Mulyorejo, Surabaya, Indonesia

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.20473/jkr.v7i2.40036

Abstract

Cancer is a disease caused by protein mutations, which cause cells to proliferate uncontrollably. Inhibiting the action of protein kinases is one method of preventing the signal that initiates the process of uncontrolled cell proliferation. This research aimed to determine the affinity of thiourea-derived compound ligands with the protein tyrosine kinase enzyme (PDB ID: 5LMA). The binding energy between each ligand and the tyrosine kinase receptor ranged from -87,62 to -95,26 kcal/mol. The percentage of ligand interactions varies above 80%. On the active site of the amino acid residues Leu 456, Leu 495, Ala 496, Ala 497, Arg 498, and Val 500, the tyrosine kinase enzyme binds to the ligands of thiourea-derived compounds via hydrogen, pi alkyl, and alkyl bonds. Pharmacokinetic, toxicity, and Lipinski regulation of thiourea-derived compounds yielded significant results as anticancer drug candidates.
Co-Authors ', Arnida Arif, Arwin Astri Riance Budi Mulyati, Budi Fajar Yudha Febi Fachriyah Pratama Muri Furti Okliantoni Pratiwi Hermina Ihsan Widiantono Indah Solihah Novia Candry Oktia Charmila Rokhaidah Septi Kurniasari Siti Nurmaliza Sri Sutjiningtyas Wasisto Utomo Yoga Nicolas Pradipta Yufitriana Amir Yulia Irvani Dewi