Ligand-Based and Docking-Based Virtual Screening of MDM2 Inhibitors as Potent Anticancer Agents
A ligand-based and docking-based virtual screening was carried out to identify novel MDM2 inhibitors. A pharmacophore model with four features was used for virtual screening, followed by molecular docking. Seventeen compounds were selected for an in vitro MDM2 inhibition assay, and compounds AO-476/...
Main Authors: | Bing-Hui Li, Jun-Qi Ge, Ya-Li Wang, Li-Jun Wang, Qi Zhang, Cong Bian |
---|---|
Format: | Article |
Language: | English |
Published: |
Hindawi Limited
2021-01-01
|
Series: | Computational and Mathematical Methods in Medicine |
Online Access: | http://dx.doi.org/10.1155/2021/3195957 |
Similar Items
-
Structure- and ligand-based virtual screening identifies new scaffolds for inhibitors of the oncoprotein MDM2.
by: Douglas R Houston, et al.
Published: (2015-01-01) -
Structure based virtual screening, docking and molecular dynamic simulation studies to identify potent mdm2-p53 inhibitors: Future implications for cancer therapy
by: B Vijay Raj, et al.
Published: (2017-01-01) -
Generation of Ligand-Based Pharmacophore Model and Virtual Screening for Identification of Novel Tubulin Inhibitors with Potent Cellular Anticancer Activity
by: Chiang,Yi-Kun, et al.
Published: (2008) -
New classes of potent heparanase inhibitors from ligand-based virtual screening
by: Daniele Pala, et al.
Published: (2020-01-01) -
Discovery of Potent Disheveled/Dvl Inhibitors Using Virtual Screening Optimized With NMR-Based Docking Performance Index
by: Kiminori Hori, et al.
Published: (2018-09-01)