(Q42326093)

26 October 2017

Fingerprint-based in silico models for the prediction of P-glycoprotein substrates and inhibitors (English)

1 reference

26 October 2017

1 reference

3

1 reference

PMC publication ID

3445814

Vasanthanathan Poongavanam

26 October 2017

object named as

Vasanthanathan Poongavanam

series ordinal

1

0 references

Norbert Haider

object named as

Norbert Haider

series ordinal

2

0 references

language of work or name

English

0 references

publication date

29 March 2012

1 reference

Bioorganic & Medicinal Chemistry

26 October 2017

1 reference

26 October 2017

20

1 reference

26 October 2017

18

1 reference

26 October 2017

5388-5395

1 reference

P-glycoprotein substrate models using support vector machines based on a comprehensive data set.

26 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Exhaustive sampling of docking poses reveals binding hypotheses for propafenone type inhibitors of P-glycoprotein

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

A novel approach for predicting P-glycoprotein (ABCB1) inhibition using molecular interaction fields

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Predicting drug-drug interactions: an FDA perspective

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Human ATP-binding cassette (ABC) transporter family

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Structure, function, and evolution of bacterial ATP-binding cassette systems

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

The role of ABC transporters in drug absorption, distribution, metabolism, excretion and toxicity (ADME-Tox).

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Computational models for prediction of interactions with ABC-transporters

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Quantification and characterization of P-glycoprotein-substrate interactions

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

In vitro p-glycoprotein inhibition assays for assessment of clinical drug interaction potential of new drug candidates: a recommendation for probe substrates.

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

A rapid computational filter for cytochrome P450 1A2 inhibition potential of compound libraries

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Predicting drug sensitivity and resistance: profiling ABC transporter genes in cancer cells

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Application of three-dimensional quantitative structure-activity relationships of P-glycoprotein inhibitors and substrates

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Multidrug resistance in cancer: role of ATP-dependent transporters

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

The human ATP-binding cassette (ABC) transporter superfamily

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

P-glycoprotein and multidrug resistance

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

ABC Transporters: From Microorganisms to Man

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Combined pharmacophore modeling, docking, and 3D QSAR studies of ABCB1 and ABCC1 transporter inhibitors

29 May 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Drug-drug interactions mediated through P-glycoprotein: clinical relevance and in vitro-in vivo correlation using digoxin as a probe drug

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Identifying P-glycoprotein substrates using a support vector machine optimized by a particle swarm

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Prediction of P-glycoprotein substrates by a support vector machine approach.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

ADME evaluation in drug discovery. 4. Prediction of aqueous solubility based on atom contribution approach.

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

A computational ensemble pharmacophore model for identifying substrates of P-glycoprotein

17 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3445814

Quantitative Structure-Activity Relationship of Multidrug Resistance Reversal Agents

17 August 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22595422

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Multivariate modeling of cytochrome P450 3A4 inhibition

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22595422

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Functionality pattern matching as an efficient complementary structure/reaction search tool: an open-source approach

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22595422

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1016/J.BMC.2012.03.045

1 reference

26 October 2017

1 reference

PMC publication ID

3445814

26 October 2017

PubMed publication ID

22595422

1 reference

PMC publication ID

3445814