Interaction of novel hybrid compounds with the D3 dopamine receptor: Site-directed mutagenesis and homology modeling studies

S Kortagere, SY Cheng, T Antonio, J Zhen… - Biochemical …, 2011 - Elsevier
The dopamine D3 receptor has been implicated as a potential target for drug development
in various complex psychiatric disorders including psychosis, drug dependence, and …

Modeling and protein engineering studies of active and inactive states of human dopamine D2 receptor (D2R) and investigation of drug/receptor interactions

RE Salmas, M Yurtsever, M Stein, S Durdagi - Molecular diversity, 2015 - Springer
Homology model structures of the dopamine D2 receptor (D2R) were generated starting
from the active and inactive states of\upbeta β 2-adrenergic crystal structure templates. To …

Structure‐Based Virtual Screening for Dopamine D2 Receptor Ligands as Potential Antipsychotics

AA Kaczor, AG Silva, MI Loza, P Kolb… - …, 2016 - Wiley Online Library
Abstract Structure‐based virtual screening using a D2 receptor homology model was
performed to identify dopamine D2 receptor ligands as potential antipsychotics. From …

Beyond small-molecule SAR: using the dopamine D3 receptor crystal structure to guide drug design

TM Keck, C Burzynski, L Shi, AH Newman - Advances in Pharmacology, 2014 - Elsevier
The dopamine D3 receptor is a target of pharmacotherapeutic interest in a variety of
neurological disorders including schizophrenia, restless leg syndrome, and drug addiction …

Conformational Analysis of D1 Dopamine Receptor Agonists:  Pharmacophore Assessment and Receptor Mapping

DM Mottola, S Laiter, VJ Watts, A Tropsha… - Journal of medicinal …, 1996 - ACS Publications
Computer-aided conformational analysis was used to characterize the agonist
pharmacophore for D1 dopamine receptor recognition and activation. Dihydrexidine (DHX) …

The dopamine D2 receptor dimer and its interaction with homobivalent antagonists: homology modeling, docking and molecular dynamics

AA Kaczor, M Jörg, B Capuano - Journal of Molecular Modeling, 2016 - Springer
In order to apply structure-based drug design techniques to G protein-coupled receptor
complexes, it is essential to model their 3D structure and to identify regions that are suitable …

Comparative molecular field analysis-based prediction of drug affinities at recombinant D1A dopamine receptors

MYK Brusniak, RS Pearlman, KA Neve… - Journal of medicinal …, 1996 - ACS Publications
Determination of quantitative structure− activity relationships (QSAR) for affinity at particular
dopamine (DA) receptors has become an even greater priority with the cloning of five DA …

Haloperidol bound D2 dopamine receptor structure inspired the discovery of subtype selective ligands

L Fan, L Tan, Z Chen, J Qi, F Nie, Z Luo… - Nature …, 2020 - nature.com
The D2 dopamine receptor (DRD2) is one of the most well-established therapeutic targets
for neuropsychiatric and endocrine disorders. Most clinically approved and investigational …

N-(ω-(4-(2-Methoxyphenyl)piperazin-1-yl)alkyl)carboxamides as Dopamine D2 and D3 Receptor Ligands

A Hackling, R Ghosh, S Perachon, A Mann… - Journal of medicinal …, 2003 - ACS Publications
The dopamine D3 receptor is recognized as a potential therapeutic target for the treatment of
various neurological and psychiatric disorders. Targetting high affinity and D3 versus D2 …

A Molecular Basis for Selective Antagonist Destabilization of Dopamine D3 Receptor Quaternary Organization

S Marsango, G Caltabiano, M Jiménez-Rosés… - Scientific Reports, 2017 - nature.com
The dopamine D3 receptor (D3R) is a molecular target for both first-generation and several
recently-developed antipsychotic agents. Following stable expression of this mEGFP-tagged …