Virtual Screening and Molecular Dynamics Study of Potential Negative Allosteric Modulators of mGluR1 from Chinese Herbs

Acyl-2-aminobenzimidazoles: A novel class of neuroprotective agents targeting mGluR5

(2015) Xinhua He et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Cyclopropyl-containing positive allosteric modulators of metabotropic glutamate receptor subtype 5

(2015) Sirish K. Lakkaraju et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

A combination of pharmacophore modeling, molecular docking, and virtual screening for P2Y12 receptor antagonists from Chinese herbs

(2015) Yusu He et al.   CANADIAN JOURNAL OF CHEMISTRY

A Novel Class of Succinimide-Derived Negative Allosteric Modulators of Metabotropic Glutamate Receptor Subtype 1 Provides Insight into a Disconnect in Activity between the Rat and Human Receptors

(2014) Hyekyung P. Cho et al.   ACS Chemical Neuroscience

The Discovery of Potentially Selective Human Neuronal Nitric Oxide Synthase (nNOS) Inhibitors: A Combination of Pharmacophore Modelling, CoMFA, Virtual Screening and Molecular Docking Studies

(2014) Guanhong Xu et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

A systematic review on the efficacy, safety and types of Chinese herbal medicine for depression

(2014) Wing-Fai Yeung et al.   JOURNAL OF PSYCHIATRIC RESEARCH

Structure of class C GPCR metabotropic glutamate receptor 5 transmembrane domain

(2014) Andrew S. Doré et al.   NATURE

mGluR5: Exploration of Orthosteric and Allosteric Ligand Binding Pockets and Their Applications to Drug Discovery

(2014) Christina Mølck et al.   NEUROCHEMICAL RESEARCH

Structure of a Class C GPCR Metabotropic Glutamate Receptor 1 Bound to an Allosteric Modulator

(2014) H. Wu et al.   SCIENCE

A double effect molecular switch leads to a novel potent negative allosteric modulator of metabotropic glutamate receptor 5

(2014) X. Gómez-Santacana et al.   MedChemComm

Drug Discovery: Structure-led design

(2013) Monica Hoyos Flight   NATURE

Structural basis for modulation of a G-protein-coupled receptor by allosteric drugs

(2013) Ron O. Dror et al.   NATURE

Emerging paradigms in GPCR allostery: implications for drug discovery

(2013) Denise Wootten et al.   NATURE REVIEWS DRUG DISCOVERY

Structure and ligand recognition of class C GPCRs

(2012) Lei Chun et al.   ACTA PHARMACOLOGICA SINICA

3-Phenyl-5-isothiazole carboxamides with potent mGluR1 antagonist activity

(2012) Matthew J. Fisher et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Neural Regeneration: Role of Traditional Chinese Medicine in Neurological Diseases Treatment

(2012) Zhi-Li Ren et al.   JOURNAL OF PHARMACOLOGICAL SCIENCES

The natural products magnolol and honokiol are positive allosteric modulators of both synaptic and extra-synaptic GABAA receptors

(2012) Mikhail Alexeev et al.   NEUROPHARMACOLOGY

Discovery of novel mGluR1 antagonists: A multistep virtual screening approach based on an SVM model and a pharmacophore hypothesis significantly increases the hit rate and enrichment factor

(2011) Guo-Bo Li et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

ASD: a comprehensive database of allosteric proteins and modulators

(2010) Z. Huang et al.   NUCLEIC ACIDS RESEARCH

Scoring functions and their evaluation methods for protein–ligand docking: recent advances and future directions

(2010) Sheng-You Huang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Synergism of virtual screening and medicinal chemistry: Identification and optimization of allosteric antagonists of metabotropic glutamate receptor 1

(2009) Tobias Noeske et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Identification of a novel transmembrane domain involved in the negative modulation of mGluR1 using a newly discovered allosteric mGluR1 antagonist, 3-cyclohexyl-5-fluoro-6-methyl-7-(2-morpholin-4-ylethoxy)-4H-chromen-4-one

(2009) Junko Fukuda et al.   NEUROPHARMACOLOGY

Positive and Negative Modulation of Group I Metabotropic Glutamate Receptors

(2008) Maksims Vanejevs et al.   JOURNAL OF MEDICINAL CHEMISTRY

Role of metabotropic glutamate receptors in the control of neuroendocrine function

(2008) Daniela Durand et al.   NEUROPHARMACOLOGY

3D-QSAR studies of triazafluorenone inhibitors of metabotropic glutamate receptor subtype 1

(2007) Y. Nataraja Sekhar et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY