(Q33317445)

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Structure-activity relationship analysis of N-benzoylpyrazoles for elastase inhibitory activity: a simplified approach using atom pair descriptors

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scholarly article

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Europe PubMed Central

PubMed publication ID

25 July 2017

Structure-activity relationship analysis of N-benzoylpyrazoles for elastase inhibitory activity: a simplified approach using atom pair descriptors (English)

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

Andrei I Khlebnikov

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Andrei I Khlebnikov

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Igor A Schepetkin

2

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Igor A Schepetkin

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

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Mark T Quinn

3

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Europe PubMed Central

PubMed publication ID

25 July 2017

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publication date

15 January 2008

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Europe PubMed Central

PubMed publication ID

25 July 2017

Bioorganic & Medicinal Chemistry

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Europe PubMed Central

PubMed publication ID

25 July 2017

16

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Europe PubMed Central

PubMed publication ID

25 July 2017

6

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

2791-2802

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

Structure-activity relationships for the design of small-molecule inhibitors.

1 reference

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Potential role of inhibitors of neutrophil elastase in treating diseases of the airway

1 reference

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Physicochemical descriptors in property-based drug design

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1 reference

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Structure-activity relationship approaches and applications

1 reference

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Anti-inflammatory activity of neutrophil elastase inhibitors.

1 reference

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Optimization of focused chemical libraries using recursive partitioning

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On combining recursive partitioning and simulated annealing to detect groups of biologically active compounds

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Prediction of binding for a kind of non-peptic HCV NS3 serine protease inhibitors from plants by molecular docking and MM-PBSA method

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A QSAR model of HERG binding using a large, diverse, and internally consistent training set.

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Generation of ligand conformations in continuum solvent consistent with protein active site topology: application to thrombin

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31 October 2018

Neutrophil elastase promotes lung microvascular injury and proteolysis of endothelial cadherins

1 reference

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31 October 2018

Quantitative structure-activity relationship (QSAR) study of elastase substrates and inhibitors

1 reference

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31 October 2018

Representation of molecular structure using quantum topology with inductive logic programming in structure–activity relationships

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N-benzoylpyrazoles are novel small-molecule inhibitors of human neutrophil elastase

1 reference

https://pubmed.ncbi.nlm.nih.gov/18234502

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

The role of the European Chemicals Bureau in promoting the regulatory use of (Q)SAR methods†

1 reference

https://pubmed.ncbi.nlm.nih.gov/18234502

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Optimal neighbor selection in molecular similarity: comparison of arbitrary versus tailored prediction spaces

1 reference

https://pubmed.ncbi.nlm.nih.gov/18234502

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Identifiers

10.1016/J.BMC.2008.01.014

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

PMC publication ID

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

25 July 2017

ResearchGate publication ID

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