(Q47428755)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

title

Prediction of chemical-protein interactions: multitarget-QSAR versus computational chemogenomic methods (English)

1 reference

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6 February 2020

main subject

computational biology

1 reference

1

1 reference

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6 February 2020

Feixiong Cheng

2

1 reference

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6 February 2020

3

Yadi Zhou

1 reference

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6 February 2020

author name string

Jie Li

4

1 reference

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6 February 2020

Weihua Li

5

1 reference

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6 February 2020

Guixia Liu

6

1 reference

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6 February 2020

Yun Tang

7

1 reference

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6 February 2020

publication date

2 July 2012

1 reference

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6 February 2020

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

volume

8

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

issue

9

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

page(s)

2373-2384

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

Network pharmacology: the next paradigm in drug discovery

6 February 2020

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Computational repositioning of the anticonvulsant topiramate for inflammatory bowel disease

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Prediction of drug-target interactions and drug repositioning via network-based inference

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Chemogenomic approaches to rational drug design

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Computational analysis of ligand relationships within target families

21 January 2018

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Insights into binding modes of adenosine A(2B) antagonists with ligand-based and receptor-based methods.

21 January 2018

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PharmMapper server: a web server for potential drug target identification using pharmacophore mapping approach

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TarFisDock: a web server for identifying drug targets with docking approach

21 January 2018

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Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.

21 January 2018

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Alignment-free prediction of a drug-target complex network based on parameters of drug connectivity and protein sequence of receptors.

21 January 2018

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Computer-aided prediction for medicinal chemistry via the Internet.

21 January 2018

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Computational screening for active compounds targeting protein sequences: methodology and experimental validation

21 January 2018

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Drug discovery using chemical systems biology: identification of the protein-ligand binding network to explain the side effects of CETP inhibitors

21 January 2018

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How many drug targets are there?

21 January 2018

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ChEMBL: a large-scale bioactivity database for drug discovery

21 January 2018

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Virtual screening of selective multitarget kinase inhibitors by combinatorial support vector machines

21 January 2018

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Dissecting kinase profiling data to predict activity and understand cross-reactivity of kinase inhibitors.

21 January 2018

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Estimation of ADME properties with substructure pattern recognition.

21 January 2018

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PROFEAT: a web server for computing structural and physicochemical features of proteins and peptides from amino acid sequence

21 January 2018

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Classification of cytochrome P450 inhibitors and noninhibitors using combined classifiers

21 January 2018

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Assessing the accuracy of prediction algorithms for classification: an overview

21 January 2018

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Predicting drug-target interaction networks based on functional groups and biological features

21 January 2018

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DrugBank: a knowledgebase for drugs, drug actions and drug targets

21 January 2018

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From genomics to chemical genomics: new developments in KEGG

21 January 2018

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Cytoscape: a software environment for integrated models of biomolecular interaction networks

21 January 2018

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Cocaine pharmacology and current pharmacotherapies for its abuse

21 January 2018

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Dopaminergic agents for the treatment of cocaine abuse

21 January 2018

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Cocaine abuse: hard knocks for the dopamine hypothesis?

21 January 2018

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Uptake of (3H)-catecholamines by homogenates of rat corpus striatum and cerebral cortex: effects of amphetamine analogues

21 January 2018

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https://api.crossref.org/works/10.1039%2FC2MB25110H

Desipramine facilitation of initial cocaine abstinence.

21 January 2018

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A quantitative analysis of kinase inhibitor selectivity

21 January 2018

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Molecular design and biological activity of potent and selective protein kinase inhibitors related to balanol

21 January 2018

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Proteochemometric recognition of stable kinase inhibition complexes using topological autocorrelation and support vector machines.

21 January 2018

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Proteochemometric modeling as a tool to design selective compounds and for extrapolating to novel targets

21 January 2018

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Virtual screening of GPCRs: an in silico chemogenomics approach

21 January 2018

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Ligand prediction from protein sequence and small molecule information using support vector machines and fingerprint descriptors

21 January 2018

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A chemogenomics view on protein-ligand spaces

21 January 2018

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Development and validation of a novel protein-ligand fingerprint to mine chemogenomic space: application to G protein-coupled receptors and their ligands.

21 January 2018

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In silico assessment of chemical biodegradability.

21 January 2018

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Simple sequence-based kernels do not predict protein-protein interactions

21 January 2018

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Drug-target residence time: critical information for lead optimization.

21 January 2018

1 reference

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Kinase-kernel models: accurate in silico screening of 4 million compounds across the entire human kinome

21 January 2018

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QSAR Modelling of Rat Acute Toxicity on the Basis of PASS Prediction

21 January 2018

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Inhibitors of protein kinase C. 1. 2,3-bisarylmaleimides

21 January 2018

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21 January 2018

Identifiers

DOI

10.1039/C2MB25110H

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22751809%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

1 reference