Three-dimensional quantitative structure–activity relationships study on HIV-1 reverse transcriptase inhibitors in the class of dipyridodiazepinone derivatives, using comparative molecular field analysis

Pornpan Pungpo; Supa Hannongbua

doi:10.1016/s1093-3263(00)00053-x

Three-dimensional quantitative structure–activity relationships study on HIV-1 reverse transcriptase inhibitors in the class of dipyridodiazepinone derivatives, using comparative molecular field analysis

Journal of Molecular Graphics and Modelling ◽

10.1016/s1093-3263(00)00053-x ◽

2000 ◽

Vol 18 (6) ◽

pp. 581-590 ◽

Cited By ~ 23

Author(s):

Pornpan Pungpo ◽

Supa Hannongbua

Keyword(s):

Reverse Transcriptase ◽

Three Dimensional ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Reverse Transcriptase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Hiv 1

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Three Dimensional Quantitative Structure-Activity Relationships of Sulfonamides Binding Monoclonal Antibody by Comparative Molecular Field Analysis

Nature Precedings ◽

10.1038/npre.2008.2646.1 ◽

2008 ◽

Author(s):

Zhanhui Wang ◽

Xingyuan Cao ◽

Zhenpeng Kai ◽

Ross Beier ◽

Congming Wu ◽

...

Keyword(s):

Monoclonal Antibody ◽

Three Dimensional ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Molecular Field Analysis ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Three-Dimensional Quantitative Structure−Activity Relationships of Cyclo-oxygenase-2 (COX-2) Inhibitors: A Comparative Molecular Field Analysis

Journal of Medicinal Chemistry ◽

10.1021/jm0101343 ◽

2001 ◽

Vol 44 (20) ◽

pp. 3223-3230 ◽

Cited By ~ 76

Author(s):

Philippe Chavatte ◽

Saïd Yous ◽

Christophe Marot ◽

Nicolas Baurin ◽

Daniel Lesieur

Keyword(s):

Three Dimensional ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Cox 2 ◽

Quantitative Structure Activity Relationships ◽

Cox 2 Inhibitors

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Three-Dimensional Quantitative Structure−Activity Relationship Study on Cyclic Urea Derivatives as HIV-1 Protease Inhibitors: Application of Comparative Molecular Field Analysis†

Journal of Medicinal Chemistry ◽

10.1021/jm980369n ◽

1999 ◽

Vol 42 (2) ◽

pp. 249-259 ◽

Cited By ~ 53

Author(s):

Asim Kumar Debnath

Keyword(s):

Protease Inhibitors ◽

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Field Analysis ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Urea Derivatives ◽

Structure Activity ◽

Relationship Study ◽

Hiv 1

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Three-Dimensional Quantitative Structure-Activity Relationship Studies on UGT1A9-Mediated 3-O-Glucuronidation of Natural Flavonols Using a Pharmacophore-Based Comparative Molecular Field Analysis Model

Journal of Pharmacology and Experimental Therapeutics ◽

10.1124/jpet.110.175356 ◽

2010 ◽

Vol 336 (2) ◽

pp. 403-413 ◽

Cited By ~ 31

Author(s):

Baojian Wu ◽

John Kenneth Morrow ◽

Rashim Singh ◽

Shuxing Zhang ◽

Ming Hu

Keyword(s):

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Field Analysis ◽

Molecular Field ◽

Activity Relationship ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Analysis Model ◽

Structure Activity

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Three-Dimensional Quantitative Structure-Activity Relationship of ArylalkylamineN-acetyltransferase (AANAT) Inhibitors: A Comparative Molecular Field Analysis

Quantitative Structure-Activity Relationships ◽

10.1002/1521-3838(200112)20:5/6<414::aid-qsar414>3.0.co;2-v ◽

2001 ◽

Vol 20 (5-6) ◽

pp. 414-421 ◽

Cited By ~ 2

Author(s):

Philippe Chavatte ◽

Saïd Yous ◽

Nathalie Beaurain ◽

Christophe Mésangeau ◽

Gilles Ferry ◽

...

Keyword(s):

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Field Analysis ◽

Molecular Field ◽

Activity Relationship ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Of

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3D-Quantitative Structure-Activity Relationships: Nonlinear Dependence Described Directly from 3D Structures Using a Comparative Molecular Field Analysis (CoMFA) Approach

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.2660110302 ◽

1992 ◽

Vol 11 (3) ◽

pp. 309-317 ◽

Cited By ~ 15

Author(s):

Ki Hwan Kim

Keyword(s):

Field Analysis ◽

Molecular Field ◽

Nonlinear Dependence ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

3D Structures ◽

Structure Activity Relationships ◽

Molecular Field Analysis ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Three-Dimensional Quantitative Structure-Activity Relationships of Somatostatin Analogs. 1. Comparative Molecular Field Analysis of Growth Hormone Release-Inhibiting Potencies

Journal of Medicinal Chemistry ◽

10.1021/jm00011a017 ◽

1995 ◽

Vol 38 (11) ◽

pp. 1974-1989 ◽

Cited By ~ 11

Author(s):

Simon J. Hocart ◽

Vik Reddy ◽

William A. Murphy ◽

David H. Coy

Keyword(s):

Growth Hormone ◽

Somatostatin Analogs ◽

Three Dimensional ◽

Field Analysis ◽

Comparative Molecular Field Analysis ◽

Hormone Release ◽

Growth Hormone Release ◽

Quantitative Structure ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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3D-Quantitative Structure-Activity Relationships: Describing Hydrophobic Interactions Directly from 3D Structures Using a Comparative Molecular Field Analysis (CoMFA) Approach

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19930120303 ◽

1993 ◽

Vol 12 (3) ◽

pp. 232-238 ◽

Cited By ~ 21

Author(s):

Ki Hwan Kim

Keyword(s):

Hydrophobic Interactions ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

3D Structures ◽

Structure Activity Relationships ◽

Molecular Field Analysis ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Comparative Molecular Field Analysis of HIV-1 Reverse Transcriptase Inhibitors in the Class of 1[(2-Hydroxyethoxy)-methyl]-6-(phenylthio)thymine

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19960150504 ◽

1996 ◽

Vol 15 (5) ◽

pp. 389-394 ◽

Cited By ~ 27

Author(s):

Supa Hannongbua ◽

Luckhana Lawtrakul ◽

Christoph A. Sotriffer ◽

Bernd M. Rode

Keyword(s):

Reverse Transcriptase ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Reverse Transcriptase Inhibitors ◽

Molecular Field Analysis ◽

Hiv 1

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Computational Studies on Tetrahydropyrimidine-2-one HIV-1 Protease Inhibitors: Improving Three-Dimensional Quantitative Structure−Activity Relationship Comparative Molecular Field Analysis Models by Inclusion of Calculated Inhibitor- and Receptor-Based Properties

Journal of Medicinal Chemistry ◽

10.1021/jm010417v ◽

2002 ◽

Vol 45 (4) ◽

pp. 973-983 ◽

Cited By ~ 45

Author(s):

Anil C. Nair ◽

Philippa Jayatilleke ◽

Xia Wang ◽

Stanislav Miertus ◽

William J. Welsh

Keyword(s):

Protease Inhibitors ◽

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Field Analysis ◽

Computational Studies ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Activity ◽

Analysis Models ◽

Hiv 1

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