(Q46183766)

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3D-QSAR CoMFA Study to Predict Orientation of Suprahistaprodifens and Phenoprodifens in the Binding-Pocket of Four Histamine H1 -Receptor Species

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

3D-QSAR CoMFA Study to Predict Orientation of Suprahistaprodifens and Phenoprodifens in the Binding-Pocket of Four Histamine H1 -Receptor Species (English)

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

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Andrea Straßer

1

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

Hans-Joachim Wittmann

2

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

publication date

12 April 2010

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

Molecular Informatics

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

29

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PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

4

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

333-341

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Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

Molecular mechanisms of ligand binding, signaling, and regulation within the superfamily of G-protein-coupled receptors: molecular modeling and mutagenesis approaches to receptor structure and function

1 reference

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Histaprodifens: synthesis, pharmacological in vitro evaluation, and molecular modeling of a new class of highly active and selective histamine H(1)-receptor agonists

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Site-directed mutagenesis of the histamine H1-receptor reveals a selective interaction of asparagine207 with subclasses of H1-receptor agonists

1 reference

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Mutational analysis of the antagonist-binding site of the histamine H(1) receptor

1 reference

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Delineation of receptor-ligand interactions at the human histamine H1 receptor by a combined approach of site-directed mutagenesis and computational techniques - or - how to bind the H1 receptor

1 reference

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21 January 2018

Pharmacological differences between human and guinea pig histamine H1 receptors: Asn84 (2.61) as key residue within an additional binding pocket in the H1 receptor

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Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins

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Synthesis of some substituted pyrazinopyridoindoles and 3D QSAR studies along with related compounds: piperazines, piperidines, pyrazinoisoquinolines, and diphenhydramine, and its semi-rigid analogs as antihistamines (H1).

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Contribution of binding enthalpy and entropy to affinity of antagonist and agonist binding at human and guinea pig histamine H(1)-receptor

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Crystal structure of the human beta2 adrenergic G-protein-coupled receptor

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GPCR engineering yields high-resolution structural insights into beta2-adrenergic receptor function

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Modeling activated states of GPCRs: the rhodopsin template

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Analysis of the activation mechanism of the guinea-pig Histamine H1-receptor

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Ligand-specific contribution of the N terminus and E2-loop to pharmacological properties of the histamine H1-receptor

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GROMACS: fast, flexible, and free

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Relationship between the inhibition constant (K1) and the concentration of inhibitor which causes 50 per cent inhibition (I50) of an enzymatic reaction

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3D-QSAR studies with the aid of molecular docking for a series of non-steroidal FXR agonists

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8 April 2023

Identifiers

10.1002/MINF.200900036

1 reference

Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

20 December 2017

http://europepmc.org/abstract/MED/27463060

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