(Q34014895)

30 July 2017

title

Predictive models for cytochrome p450 isozymes based on quantitative high throughput screening data (English)

1 reference

30 July 2017

4

Christopher P Austin

1 reference

30 July 2017

Hongmao Sun

1

1 reference

30 July 2017

Henrike Veith

series ordinal

2

1 reference

30 July 2017

Menghang Xia

series ordinal

3

1 reference

30 July 2017

Ruili Huang

series ordinal

5

1 reference

30 July 2017

publication date

26 September 2011

1 reference

Journal of Chemical Information and Modeling

30 July 2017

published in

1 reference

30 July 2017

volume

51

1 reference

30 July 2017

issue

10

1 reference

30 July 2017

page(s)

2474-2481

1 reference

Structural features of cytochromes P450 and ligands that affect drug metabolism as revealed by X-ray crystallography and NMR.

30 July 2017

cites work

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Conformational plasticity and structure/function relationships in cytochromes P450.

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Comprehensive characterization of cytochrome P450 isozyme selectivity across chemical libraries

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

QSAR of cytochrome inhibitors

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Medicinal chemistry strategies to reduce CYP2D6 inhibitory activity of lead candidates

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Human P450s involved in drug metabolism and the use of structural modelling for understanding substrate selectivity and binding affinity

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Structure of cytochrome p450s and personalized drug

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Adaptations for the oxidation of polycyclic aromatic hydrocarbons exhibited by the structure of human P450 1A2

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

What is a support vector machine?

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Structural basis for ligand promiscuity in cytochrome P450 3A4.

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Computational models for predicting interactions with cytochrome p450 enzyme

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Machine learning techniques for in silico modeling of drug metabolism

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Quantitative high-throughput screening: a titration-based approach that efficiently identifies biological activities in large chemical libraries

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Luminogenic cytochrome P450 assays

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Crystal structure of human cytochrome P450 2D6

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Crystal structures of human cytochrome P450 3A4 bound to metyrapone and progesterone

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

SVM-based feature selection for characterization of focused compound collections

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Crystal structure of human cytochrome P450 2C9 with bound warfarin

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Science, medicine, and the future: Pharmacogenetics

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

CYP3A4 drug interactions: correlation of 10 in vitro probe substrates

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Pharmacogenomics: translating functional genomics into rational therapeutics

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Ethanol enhances the hemodynamic effects of felodipine.

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Improvement in aqueous solubility in small molecule drug discovery programs by disruption of molecular planarity and symmetry

28 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Development of CYP3A4 inhibition models: comparisons of machine-learning techniques and molecular descriptors.

29 October 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

Activation of CYP3A4: evidence for the simultaneous binding of two substrates in a cytochrome P450 active site.

29 October 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3200453

The importance of the domain of applicability in QSAR modeling

29 October 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/21905670

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

A universal molecular descriptor system for prediction of logP, logS, logBB, and absorption

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/21905670

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1021/CI200311W

1 reference

30 July 2017

DBLP publication ID

journals/jcisd/SunVXAH11

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference

30 July 2017

1 reference