International Journal of Molecular Sciences | |
Studies of New Fused Benzazepine as Selective Dopamine D3 Receptor Antagonists Using 3D-QSAR, Molecular Docking and Molecular Dynamics | |
Jing Liu2  Yan Li2  Shuwei Zhang2  Zhengtao Xiao1  | |
[1] Center of Bioinformatics, Northwest A&F University, Yangling, Shaanxi, 712100, China; E-Mail:;School of Chemical Engineering, Dalian University of Technology, Dalian, 116012, Liaoning, China; E-Mails: | |
关键词: 3D-QSAR; dopamine D3 receptor; antagonist; CoMFA; CoMSIA; | |
DOI : 10.3390/ijms12021196 | |
来源: mdpi | |
【 摘 要 】
In recent years, great interest has been paid to the development of compounds with high selectivity for central dopamine (DA) D3 receptors, an interesting therapeutic target in the treatment of different neurological disorders. In the present work, based on a dataset of 110 collected benzazepine (BAZ) DA D3 antagonists with diverse kinds of structures, a variety of
【 授权许可】
CC BY
© 2011 by the authors; licensee MDPI, Basel, Switzerland.
【 预 览 】
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