Identification of novel discoidin domain receptor 1 (DDR1) inhibitors using E-pharmacophore modeling, structure-based virtual screening, molecular dynamics simulation and MM-GBSA approaches-Reference-Cited by-同舟云学术

Identification of novel discoidin domain receptor 1 (DDR1) inhibitors using E-pharmacophore modeling, structure-based virtual screening, molecular dynamics simulation and MM-GBSA approaches

Published:2022-03 Issue: Volume:142 Page:105217
ISSN:0010-4825
Container-title:Computers in Biology and Medicine
language:en
Short-container-title:Computers in Biology and Medicine

Author:

Nada Hossam^ORCID,Lee Kyeong,Gotina Lizaveta^ORCID,Pae Ae Nim,Elkamhawy Ahmed^ORCID

Funder

Ministry of Education

Ministry of Science, ICT and Future Planning

National Research Foundation of Korea

Publisher

Elsevier BV

Subject

Health Informatics,Computer Science Applications

Reference63 articles.

1. New concepts on the interactions of discoidin domain receptors with collagen;Fridman;Biochim. Biophys. Acta Mol. Cell Res.,2019

2. Multitasking discoidin domain receptors are involved in several and specific hallmarks of cancer;Henriet;Cell Adhes. Migrat.,2018

3. Dichotomy of the function of DDR1 in cells and disease progression;Yeh;Biochim. Biophys. Acta Mol. Cell Res.,2019

4. The journey of DDR1 and DDR2 kinase inhibitors as rising stars in the fight against;Elkamhawy;Cancer,2021

5. Discoidin domain receptor 1 is associated with poor prognosis of non-small cell lung carcinomas;Yang;Oncol. Rep.,2010

Cited by 43 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Targeting breast cancer with rationally designed quinazolines: A scaffold hopping strategy;Journal of Molecular Structure;2024-11

2. LC–MS and GC‐MS Analyses on Green Algae Penicillus Capitatus: Cytotoxic, Antimicrobial and Anticholinesterase Activity Screening Enhanced by Molecular Docking & Dynamics and ADME Studies;Chemistry & Biodiversity;2024-09-14

3. Structure-based in-silico identification of natural compounds as potential inhibitors of ran GTPase for breast cancer treatment;Biocatalysis and Agricultural Biotechnology;2024-09

4. From pixels to druggable leads: A CADD strategy for the design and synthesis of potent DDR1 inhibitors;Computer Methods and Programs in Biomedicine;2024-09

5. New tetrahydro-isoquinoline derivatives as cholinesterase and α-glycosidase inhibitors: Synthesis, characterization, molecular docking & dynamics, ADME prediction, in vitro cytotoxicity and enzyme inhibition studies;Journal of Molecular Liquids;2024-06