In silico predictive model to determine vector-mediated transport properties for the blood-brain barrier choline transporter (Q42010190)

15 October 2017

In silico predictive model to determine vector-mediated transport properties for the blood-brain barrier choline transporter (English)

1 reference

15 October 2017

1 reference

Sergey Shityakov

1

1 reference

PMCID

4159400

15 October 2017

Carola Förster

series ordinal

2

1 reference

15 October 2017

2 September 2014

1 reference

Advances and Applications in Bioinformatics and Chemistry

15 October 2017

1 reference

15 October 2017

7

1 reference

15 October 2017

23-36

1 reference

Creative Commons Attribution-NonCommercial 3.0 Unported

15 October 2017

start time

1 September 2014

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

0 references

cites work

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Qualitative prediction of blood-brain barrier permeability on a large and refined dataset

5 June 2018

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Bis-azaaromatic quaternary ammonium salts as ligands for the blood-brain barrier choline transporter

5 June 2018

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Predictive screening model for potential vector-mediated transport of cationic substrates at the blood-brain barrier choline transporter

5 June 2018

1 reference

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5 June 2018

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bis-Pyridinium cyclophanes: novel ligands with high affinity for the blood-brain barrier choline transporter

5 June 2018

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The Crystal Structure of a Sodium Galactose Transporter Reveals Mechanistic Insights into Na+/Sugar Symport

5 June 2018

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Differential effects of hydrocortisone and TNFalpha on tight junction proteins in an in vitro model of the human blood-brain barrier

5 June 2018

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I-TASSER server for protein 3D structure prediction

5 June 2018

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A semiempirical free energy force field with charge-based desolvation

5 June 2018

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Determination of therapeutics with growth-hormone secretagogue activity in human urine for doping control purposes

5 June 2018

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Donepezil, tacrine and alpha-phenyl-n-tert-butyl nitrone (PBN) inhibit choline transport by conditionally immortalized rat brain capillary endothelial cell lines (TR-BBB).

5 June 2018

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5 June 2018

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Occludin as direct target for glucocorticoid-induced improvement of blood-brain barrier properties in a murine in vitro system.

5 June 2018

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The blood-brain barrier: bottleneck in brain drug development

5 June 2018

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VADAR: a web server for quantitative evaluation of protein structure quality

5 June 2018

1 reference

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5 June 2018

The transport of choline

1 reference

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Drug and gene targeting to the brain with molecular Trojan horses

5 June 2018

1 reference

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Rapid grid-based construction of the molecular surface and the use of induced surface charge to calculate reaction field energies: applications to the molecular systems and geometric objects

5 June 2018

1 reference

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Targeting neurotherapeutic agents through the blood-brain barrier

5 June 2018

1 reference

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Characterization of the blood-brain barrier choline transporter using the in situ rat brain perfusion technique

5 June 2018

1 reference

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Designing libraries with CNS activity

5 June 2018

1 reference

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Rapid calculation of polar molecular surface area and its application to the prediction of transport phenomena. 2. Prediction of blood-brain barrier penetration

5 June 2018

1 reference

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AQUA and PROCHECK-NMR: programs for checking the quality of protein structures solved by NMR

5 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Protein model structure evaluation using the solvation free energy of folding

5 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Stereochemical quality of protein structure coordinates

5 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Analysing molecular polar surface descriptors to predict blood-brain barrier permeation

5 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Pharmacokinetic and pharmacodynamic properties of cholinesterase inhibitors donepezil, tacrine, and galantamine in aged and young Lister hooded rats.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

3-D-QSAR and docking studies on the neuronal choline transporter

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Improvement of microemulsion electrokinetic chromatography for measuring octanol-water partition coefficients

17 August 2018

1 reference

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Evaluating virtual screening methods: good and bad metrics for the "early recognition" problem.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Molecular modeling studies on the active binding site of the blood-brain barrier choline transporter

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Active transport of high-affinity choline and nicotine analogs into the central nervous system by the blood-brain barrier choline transporter

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Consideration of molecular weight during compound selection in virtual target-based database screening

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Polar molecular surface properties predict the intestinal absorption of drugs in humans.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4159400

Effect of fatty acids on the transdermal delivery of donepezil: in vitro and in vivo evaluation

17 August 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/25214795

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

On the shape of energy-detection ROC curves

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/25214795

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.2147/AABC.S63749

1 reference

15 October 2017

1 reference

15 October 2017

1 reference

PMCID

4159400