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Discovery of potent antiproliferative agents from selected oxygen heterocycles as EGFR tyrosine kinase inhibitors from the U.S. National Cancer Institute database by in silico screening and bioactivity evaluation
- Source :
- Bioorganicmedicinal chemistry letters. 58
- Publication Year :
- 2021
-
Abstract
- A similarity search was conducted on the U.S. Enhanced National Cancer Institute Database Browser 2.2 to find structures related to 1,5-dihydroxy-9H-xanthen-9-one, a previously established EGFR-TK inhibitor. Compounds were virtually screened and selected for bioactivity testing revealed 5 candidates, mostly displayed stronger antiproliferative activities than erlotinib with IC
- Subjects :
- Dose-Response Relationship, Drug
Molecular Structure
Organic Chemistry
Clinical Biochemistry
Drug Evaluation, Preclinical
Pharmaceutical Science
Antineoplastic Agents
Biochemistry
National Cancer Institute (U.S.)
United States
ErbB Receptors
Molecular Docking Simulation
Oxygen
Structure-Activity Relationship
Xanthenes
Heterocyclic Compounds
Cell Line, Tumor
Drug Discovery
Molecular Medicine
Humans
Drug Screening Assays, Antitumor
Molecular Biology
Protein Kinase Inhibitors
Cell Proliferation
Subjects
Details
- ISSN :
- 14643405
- Volume :
- 58
- Database :
- OpenAIRE
- Journal :
- Bioorganicmedicinal chemistry letters
- Accession number :
- edsair.doi.dedup.....9ac316a861dd41c367a0243a1f657225