(Q30833986)

26 September 2017

In Silico target fishing: addressing a "Big Data" problem by ligand-based similarity rankings with data fusion (English)

1 reference

26 September 2017

0 references

1 reference

1 reference

Mingyue Zheng

8

0 references

Xiaomin Luo

object named as

Xiaomin Luo

7

0 references

author name string

Xian Liu

1

1 reference

26 September 2017

Yuan Xu

2

1 reference

26 September 2017

Shanshan Li

3

1 reference

26 September 2017

Yulan Wang

4

1 reference

26 September 2017

Jianlong Peng

5

1 reference

26 September 2017

Cheng Luo

6

1 reference

26 September 2017

Kaixian Chen

9

1 reference

26 September 2017

Hualiang Jiang

10

1 reference

26 September 2017

18 June 2014

1 reference

Journal of Cheminformatics

26 September 2017

1 reference

26 September 2017

6

1 reference

26 September 2017

33

1 reference

Creative Commons Attribution 4.0 International

26 September 2017

start time

18 June 2014

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

1 reference

April 2022 Public Data File from Crossref

cites work

The ChEMBL bioactivity database: an update

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

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

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Therapeutic target database update 2012: a resource for facilitating target-oriented drug discovery.

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

ChEMBL: a large-scale bioactivity database for drug discovery

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Identifying compound-target associations by combining bioactivity profile similarity search and public databases mining

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

From in silico target prediction to multi-target drug design: current databases, methods and applications

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

DRAR-CPI: a server for identifying drug repositioning potential and adverse drug reactions via the chemical-protein interactome

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

DrugBank 3.0: a comprehensive resource for 'omics' research on drugs

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Systems approaches to polypharmacology and drug discovery

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

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

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Extended-connectivity fingerprints

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Targeting the cancer kinome through polypharmacology

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Predicting new molecular targets for known drugs

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

[6]-Gingerol suppresses colon cancer growth by targeting leukotriene A4 hydrolase

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

PDTD: a web-accessible protein database for drug target identification

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Steady-state pharmacokinetic properties of a 24-hour prolonged-release formulation of ropinirole: results of two randomized studies in patients with Parkinson's disease

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Relating protein pharmacology by ligand chemistry

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Peptide deformylase is a potential target for anti-Helicobacter pylori drugs: reverse docking, enzymatic assay, and X-ray crystallography validation

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Global mapping of pharmacological space

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

New methods for ligand-based virtual screening: use of data fusion and machine learning to enhance the effectiveness of similarity searching

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

hERG potassium channels and cardiac arrhythmia

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

A shape-based 3-D scaffold hopping method and its application to a bacterial protein-protein interaction

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Drug repositioning: identifying and developing new uses for existing drugs

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Comparison of fingerprint-based methods for virtual screening using multiple bioactive reference structures

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Drug-induced prolongation of the QT interval

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Gapped BLAST and PSI-BLAST: a new generation of protein database search programs

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Buprenorphine treatment of refractory depression

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Preclinical pharmacology of ropinirole (SK&F 101468-A) a novel dopamine D2 agonist.

21 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4068908

Sildenafil (VIAGRATM), a potent and selective inhibitor of type 5 cGMP phosphodiesterase with utility for the treatment of male erectile dysfunction

21 June 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Memantine in moderate-to-severe Alzheimer's disease

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Can an in silico drug-target search method be used to probe potential mechanisms of medicinal plant ingredients?

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Structure-Based Approaches to Target Fishing and Ligand Profiling

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Predicting polypharmacology by binding site similarity: from kinases to the protein universe

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Protein-ligand interaction prediction: an improved chemogenomics approach.

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Exploring polypharmacology using a ROCS-based target fishing approach

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Off-target networks derived from ligand set similarity

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Chemical Similarity Searching

21 January 2018

1 reference

https://api.crossref.org/works/10.1186%2F1758-2946-6-33

Colesevelam hydrochloride (cholestagel): a new, potent bile acid sequestrant associated with a low incidence of gastrointestinal side effects

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24976868

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Enhancing the Effectiveness of Virtual Screening by Fusing Nearest Neighbor Lists: A Comparison of Similarity Coefficients

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24976868

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

The relationship between rational drug design and drug side effects

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24976868

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

A boosting algorithm for learning bipartite ranking functions with partially labeled data

1 reference

COCI

https://opencitations.net/index/coci/api/v1/references/10.1186/1758-2946-6-33

2 January 2022

Identifiers

DOI

10.1186/1758-2946-6-33

1 reference

journals/jcheminf/LiuXLWPLLZCJ14

26 September 2017

1 reference

DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

1 reference

9 September 2019

https://scigraph.springernature.com/pub.10.1186/1758-2946-6-33

1 reference

26 September 2017

PubMed publication ID

24976868

1 reference