Three-dimensional quantitative structure–activity relationship studies on diverse structural classes of HIV-1 integrase inhibitors using CoMFA and CoMSIA

Activity Relationship ◽

Quantitative Structure ◽

Integrase Inhibitors ◽

Structure Activity ◽

Structural Classes ◽

Hiv 1

Quantitative Structure-Activity Relationship and Docking Studies on a Series of Oxadiazole and Triazole Substituted Naphthyridines as HIV-1 Integrase Inhibitors

Letters in Drug Design & Discovery ◽

10.2174/1570180813666160610090525 ◽

2016 ◽

Vol 14 (1) ◽

pp. 10-27 ◽

Cited By ~ 1

Author(s):

Basheerulla Shaik ◽

Vijay Agrawal ◽

Satya Gupta ◽

Urvana Menon

Keyword(s):

Docking Studies ◽

Activity Relationship ◽

Quantitative Structure ◽

Integrase Inhibitors ◽

Structure Activity ◽

Hiv 1

Antileishmanial Chalcones: Statistical Design, Synthesis, and Three-Dimensional Quantitative Structure−Activity Relationship Analysis

Journal of Medicinal Chemistry ◽

10.1021/jm980410m ◽

1998 ◽

Vol 41 (24) ◽

pp. 4819-4832 ◽

Cited By ~ 183

Author(s):

Simon Feldbæk Nielsen ◽

Søren Brøgger Christensen ◽

Gabriele Cruciani ◽

Arsalan Kharazmi ◽

Tommy Liljefors

Keyword(s):

Three Dimensional ◽

Statistical Design ◽

Activity Relationship ◽

Quantitative Structure ◽

Design Synthesis ◽

Relationship Analysis ◽

Novel Pyrazole-4-acetohydrazide Derivatives Potentially Targeting Fungal Succinate Dehydrogenase: Design, Synthesis, Three-Dimensional Quantitative Structure–Activity Relationship, and Molecular Docking

Journal of Agricultural and Food Chemistry ◽

10.1021/acs.jafc.1c03399 ◽

2021 ◽

Author(s):

Xiaobin Wang ◽

Mengqi Wang ◽

Ling Han ◽

Fei Jin ◽

Jian Jiao ◽

...

Keyword(s):

Molecular Docking ◽

Succinate Dehydrogenase ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Design Synthesis ◽

Biological Evaluation, Structure−Activity Relationships, and Three-Dimensional Quantitative Structure−Activity Relationship Studies of Dihydro-β-agarofuran Sesquiterpenes as Modulators of P-Glycoprotein-Dependent Multidrug Resistance

Journal of Medicinal Chemistry ◽

10.1021/jm070290v ◽

2007 ◽

Vol 50 (20) ◽

pp. 4808-4817 ◽

Cited By ~ 30

Author(s):

Carolina P. Reyes ◽

Francisco Muñoz-Martínez ◽

Ivan R. Torrecillas ◽

Cristina R. Mendoza ◽

Francisco Gamarro ◽

...

Keyword(s):

Multidrug Resistance ◽

Three Dimensional ◽

Biological Evaluation ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

P Glycoprotein

The use of ladder particle swarm optimisation for quantitative structure–activity relationship analysis of human immunodeficiency virus-1 integrase inhibitors

Molecular Simulation ◽

10.1080/08927022.2011.586347 ◽

2011 ◽

Vol 37 (15) ◽

pp. 1221-1233 ◽

Cited By ~ 3

Author(s):

Mehdi Jalali-Heravi ◽

Heshmatollah Ebrahimi-Najafabadi

Keyword(s):

Human Immunodeficiency Virus ◽

Activity Relationship ◽

Quantitative Structure ◽

Integrase Inhibitors ◽

Relationship Analysis ◽

Structure Activity ◽

Immunodeficiency Virus ◽

Human Immunodeficiency Virus 1

Three-dimensional quantitative structure-activity relationship (3D-QSAR) studies of various benzodiazepine analogues of γ-secretase inhibitors

Journal of Molecular Modeling ◽

10.1007/s00894-008-0361-5 ◽

2008 ◽

Vol 15 (4) ◽

pp. 343-348 ◽

Cited By ~ 4

Author(s):

Tarnvir Sammi ◽

Om Silakari ◽

Muttineni Ravikumar

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Quantitative Structure ◽

Qsar Studies ◽

Three-dimensional quantitative structure–activity relationship analyses of a series of cinnamamides

Chemometrics and Intelligent Laboratory Systems ◽

10.1016/s0169-7439(01)00116-2 ◽

2001 ◽

Vol 56 (2) ◽

pp. 123-132 ◽

Cited By ~ 15

Author(s):

Tingjun Hou ◽

Xiaojie Xu

Keyword(s):

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Cytotoxic Activity and Three-Dimensional Quantitative Structure Activity Relationship of 2-Aryl-1,8-naphthyridin-4-ones

Korean Journal of Physiology and Pharmacology ◽

10.4196/kjpp.2009.13.6.511 ◽

2009 ◽

Vol 13 (6) ◽

pp. 511 ◽

Cited By ~ 2

Author(s):

Yong Jin Kim ◽

Eun Ae Kim ◽

Mi Lyang Chung ◽

Chaeuk Im

Keyword(s):

Cytotoxic Activity ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Of

Proposal of a New Binding Orientation for Non-Peptide AT1 Antagonists: Homology Modeling, Docking and Three-Dimensional Quantitative Structure−Activity Relationship Analysis

Journal of Medicinal Chemistry ◽

10.1021/jm060338p ◽

2006 ◽

Vol 49 (14) ◽

pp. 4305-4316 ◽

Cited By ~ 60

Author(s):

Tiziano Tuccinardi ◽

Vincenzo Calderone ◽

Simona Rapposelli ◽

Adriano Martinelli

Keyword(s):

Homology Modeling ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Relationship Analysis ◽

Structure Activity ◽

At1 Antagonists ◽

Binding Orientation

Three-Dimensional Quantitative Structure-Activity Relationship Study of Antitumor 2-Formylpyridine Thiosemicarbazones Derivatives as Inhibitors of Ribonucleotide Reductase

QSAR & Combinatorial Science ◽

10.1002/qsar.200960057 ◽

2009 ◽

Vol 28 (11-12) ◽

pp. 1334-1345 ◽

Cited By ~ 3

Author(s):

Hamilton Mitsugu Ishiki ◽

Antonia T. do Amaral

Keyword(s):

Ribonucleotide Reductase ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Study