Faculty of 1000 evaluation for Structure-based discovery of prescription drugs that interact with the norepinephrine transporter, NET (original) (raw)

Structure-based discovery of prescription drugs that interact with the norepinephrine transporter, NET

John Irwin

Proceedings of the National Academy of Sciences, 2011

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Structure-Function of the High Affinity Substrate Binding Site (S1) of Human Norepinephrine Transporter

Prerna Jha

Frontiers in Pharmacology, 2020

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Structural basis of norepinephrine recognition and transport inhibition in neurotransmitter transporters

aditya kumar mallela

Nature Communications, 2021

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A short update on the structure of drug binding sites on neurotransmitter transporters

Ingebrigt Sylte

BMC Research Notes, 2011

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Determination of Residues In the Norepinephrine Transporter That Are Critical for Tricyclic Antidepressant Affinity

B. Giros

Journal of Biological …, 2001

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Membrane Transporters: Structure, Function and Targets for Drug Design

Ingebrigt Sylte

Topics in Medicinal Chemistry, 2008

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Delineation of discrete domains for substrate, cocaine, and tricyclic antidepressant interactions using chimeric dopamine-norepinephrine transporters

B. Giros

Journal of Biological Chemistry, 1994

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From linked open data to molecular interaction: studying selectivity trends for ligands of the human serotonin and dopamine transporter

Barbara Zdrazil

MedChemComm, 2016

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Identification of Novel Serotonin Transporter Compounds by Virtual Screening

rafal kurczab

Journal of Chemical Information and Modeling, 2014

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Desvenlafaxine Succinate Identifies Novel Antagonist Binding Determinants in the Human Norepinephrine Transporter

Robyn Richmond

Journal of Pharmacology and Experimental Therapeutics, 2007

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S33005, a novel ligand at both serotonin and norepinephrine transporters: I. Receptor binding, electrophysiological, and neurochemical profile in comparison with venlafaxine, reboxetine, citalopram, and clomipramine

Adrian Newman-Tancredi

The Journal of pharmacology and experimental therapeutics, 2001

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Comparative Molecular Field Analysis Using Selectivity Fields Reveals Residues in the Third Transmembrane Helix of the Serotonin Transporter Associated with Substrate and Antagonist Recognition

David Nichols

Journal of Pharmacology and Experimental Therapeutics, 2008

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Structure and Gating Dynamics of Na+/Cl– Coupled Neurotransmitter Transporters

aditya kumar mallela

Frontiers in Molecular Biosciences

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Molecular characterization of neurotransmitter transporters

Ana Guadaño

Molecular Endocrinology, 1993

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The use of LeuT as a model in elucidating binding sites for substrates and inhibitors in neurotransmitter transporters

Claus J Loland

Biochimica et Biophysica Acta (BBA) - General Subjects, 2015

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Pharmacophore-based discovery of ligands for drug transporters

Sean Ekins

Advanced Drug Delivery Reviews, 2006

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Structure-based Discovery of Conformationally Selective Inhibitors of the Serotonin Transporter

Bethlehem Bekele

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Elucidation of common pharmacophores from analysis of targeted metabolites transported by the multispecific drug transporter—Organic anion transporter1 (Oat1)

Igor Tsigelny

Bioorganic & Medicinal Chemistry, 2011

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Neurotransmitter transporters: why dance with so many partners?

Marco A González Escudero

Current Opinion in Pharmacology, 2004

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Computational modeling to accelerate the identification of substrates and inhibitors for transporters that affect drug disposition

Sean Ekins

Clinical Pharmacology and Therapeutics, 2012

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The Mechanism of a Neurotransmitter:Sodium Symporter—Inward Release of Na+ and Substrate Is Triggered by Substrate in a Second Binding Site

Harel Weinstein

Molecular Cell, 2008

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Structural basis of organic cation transporter-3 inhibition

Basavraj Khanppnavar

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Tyr-95 and Ile-172 in Transmembrane Segments 1 and 3 of Human Serotonin Transporters Interact to Establish High Affinity Recognition of Antidepressants

Randy Blakely, Roxanne Vaughan

Journal of Biological Chemistry, 2006

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Critical Amino Acid Residues in Transmembrane Span 7 of the Serotonin Transporter Identified by Random Mutagenesis

Gary Rudnick

Journal of Biological Chemistry, 1998

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Substrate-dependent proton antiport in neurotransmitter:sodium symporters

Harel Weinstein

Nature Chemical Biology, 2010

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Membrane transporters in drug development

Mikko Niemi, Volker Fischer

Nature Reviews Drug Discovery, 2010

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Conformational state interactions provide clues to the pharmacochaperone potential of serotonin transporter partial substrates

Ali El-kasaby

Journal of Biological Chemistry

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Probing the Selectivity of Monoamine Transporter Substrates by Means of Molecular Modeling

Barbara Zdrazil

Molecular Informatics, 2013

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Antidepressant binding site in a bacterial homologue of neurotransmitter transporters

Eric Gouaux

Nature, 2007

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Current Advances in Studying Clinically Relevant Transporters of the Solute Carrier (SLC) Family by Connecting Computational Modeling and Data Science

Barbara Zdrazil

Computational and Structural Biotechnology Journal, 2019

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Human dopamine transporter: the first implementation of a combined in silico/in vitro approach revealing the substrate and inhibitor specificities

Kemal Yelekci

Journal of biomolecular structure & dynamics, 2018

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