(Q27902303)

1

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Lu Liang

2

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Zheng Yin

3

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Jianping Lin

Journal of Cheminformatics

4

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language of work or name

English

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publication date

2016

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published in

1 reference

Creative Commons Attribution 4.0 International

volume

8

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issue

1

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page(s)

20

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copyright license

start time

23 April 2016

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

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cites work

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The ChEMBL bioactivity database: an update

20 March 2017

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Chemical informatics uncovers a new role for moexipril as a novel inhibitor of cAMP phosphodiesterase-4 (PDE4)

20 March 2017

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Predicting new molecular targets for known drugs

20 March 2017

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On Outliers and Activity Cliffs - Why QSAR Often Disappoints

20 March 2017

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Extended-connectivity fingerprints

20 March 2017

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Relating protein pharmacology by ligand chemistry

7 April 2017

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Global mapping of pharmacological space

7 April 2017

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A pharmacological organization of G protein-coupled receptors

7 April 2017

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Polypharmacology: drug discovery for the future

29 September 2017

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Predicting new indications for approved drugs using a proteochemometric method

29 September 2017

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Large-scale prediction and testing of drug activity on side-effect targets

29 September 2017

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Chloroquine and its analogs: a new promise of an old drug for effective and safe cancer therapies

29 September 2017

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SVM model for virtual screening of Lck inhibitors

29 September 2017

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Protein promiscuity and its implications for biotechnology

29 September 2017

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A ligand-based approach to mining the chemogenomic space of drugs

29 September 2017

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Quantifying the relationships among drug classes

29 September 2017

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29 September 2017

New uses for old drugs

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Ligand-based approach to in silico pharmacology: nuclear receptor profiling

29 September 2017

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Genetic optimization of combinatorial libraries

29 September 2017

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Empirical statistical estimates for sequence similarity searches.

29 September 2017

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Advancing the activity cliff concept

29 September 2017

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2 June 2018

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Relating anatomical therapeutic indications by the ensemble similarity of drug sets

2 June 2018

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SHED: Shannon Entropy Descriptors from Topological Feature Distributions

21 January 2018

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Extending the activity cliff concept: structural categorization of activity cliffs and systematic identification of different types of cliffs in the ChEMBL database

21 January 2018

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Fuzzy tricentric pharmacophore fingerprints. 1. Topological fuzzy pharmacophore triplets and adapted molecular similarity scoring schemes.

21 January 2018

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Multifingerprint based similarity searches for targeted class compound selection.

21 January 2018

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A ligand's-eye view of protein similarity

21 January 2018

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'Fuzziness' in pharmacophore-based virtual screening and de novo design

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/27110288

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

From the Food and Drug Administration

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/27110288

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1186/S13321-016-0130-X

1 reference

journals/jcheminf/WangLYL16

DBLP publication ID

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/s13321-016-0130-x

1 reference

1 reference

PubMed publication ID

27110288

1 reference