Three-dimensional quantitative structure–activity relationship (3D-QSAR) analysis and molecular docking of ATP-competitive triazine analogs of human mTOR inhibitors

Activity Relationship ◽

Quantitative Structure ◽

Qsar Analysis ◽

Three-dimensional quantitative structure–activity relationship (3D-QSAR) analysis and molecular docking-based combined in silico rational approach to design potent and novel TRPV1 antagonists

Medicinal Chemistry Research ◽

10.1007/s00044-012-0226-4 ◽

2012 ◽

Vol 22 (5) ◽

pp. 2312-2327 ◽

Cited By ~ 17

Author(s):

Kamlendra Singh Bhadoriya ◽

Mukesh C. Sharma ◽

Shailesh V. Jain ◽

Ganesh S. Raut ◽

Jyotsna R. Rananaware

Keyword(s):

Molecular Docking ◽

In Silico ◽

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Rational Approach ◽

Quantitative Structure ◽

Qsar Analysis ◽

New potent and selective cytochrome P450 2B6 (CYP2B6) inhibitors based on three-dimensional quantitative structure-activity relationship (3D-QSAR) analysis

British Journal of Pharmacology ◽

10.1038/sj.bjp.0707173 ◽

2007 ◽

Vol 150 (7) ◽

pp. 932-942 ◽

Cited By ~ 30

Author(s):

L E Korhonen ◽

M Turpeinen ◽

M Rahnasto ◽

C Wittekindt ◽

A Poso ◽

...

Keyword(s):

Cytochrome P450 ◽

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Quantitative Structure ◽

Qsar Analysis ◽

Cytochrome P450 2B6 ◽

Three-dimensional quantitative structure–activity relationship (3D-QSAR) analysis of CYP2B6 enzyme

Toxicology Letters ◽

10.1016/j.toxlet.2006.06.137 ◽

2006 ◽

Vol 164 ◽

pp. S66

Author(s):

Hannu Raunio ◽

Laura Korhonen ◽

Miia Turpeinen ◽

Minna Rahnasto ◽

Carsten Wittekindt ◽

...

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Quantitative Structure ◽

Qsar 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 ◽

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 (3D-QSAR) of 3-aryloxazolidin-2-one antibacterials

Bioorganic & Medicinal Chemistry ◽

10.1016/s0968-0896(01)00186-9 ◽

2001 ◽

Vol 9 (12) ◽

pp. 3153-3160 ◽

Cited By ~ 33

Author(s):

Rajeshri G. Karki ◽

Vithal M. Kulkarni

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Quantitative Structure ◽

Three-dimensional quantitative structure activity relationship (3D-QSAR) analysis for in vitro toxicity of chlorophenols to HepG2 cells

Chemosphere ◽

10.1016/j.chemosphere.2005.04.019 ◽

2005 ◽

Vol 60 (6) ◽

pp. 791-795 ◽

Cited By ~ 6

Author(s):

Y. Liu ◽

J.N. Chen ◽

J.S. Zhao ◽

H.X. Yu ◽

X.D. Wang ◽

...

Keyword(s):

Hepg2 Cells ◽

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

In Vitro Toxicity ◽

Quantitative Structure ◽

Qsar Analysis ◽

Prediction of Organophosphorus Acetylcholinesterase Inhibition Using Three-Dimensional Quantitative Structure-Activity Relationship (3D-QSAR) Methods

Toxicological Sciences ◽

10.1093/toxsci/63.2.223 ◽

2001 ◽

Vol 63 (2) ◽

pp. 223-232 ◽

Cited By ~ 39

Author(s):

J. E. Yazal

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Acetylcholinesterase Inhibition ◽

Activity Relationship ◽

Quantitative Structure ◽

ChemInform Abstract: Polarizability Fields for Use in Three-Dimensional Quantitative Structure-Activity Relationship (3D-QSAR).

ChemInform ◽

10.1002/chin.200148232 ◽

2010 ◽

Vol 32 (48) ◽

pp. no-no

Author(s):

Mary Bradley ◽

Chris L. Waller

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Activity Relationship ◽

Quantitative Structure ◽

Quantitative structure-activity relationship (QSAR) and three-dimensional QSAR analysis of a series of xanthates as inhibitors and inactivators of cytochrome P450 2B1

Xenobiotica ◽

10.1080/0049825021000012574 ◽

2002 ◽

Vol 32 (12) ◽

pp. 1063-1077 ◽

Cited By ~ 5

Author(s):

I. Lesigiarska ◽

I. Pajeva ◽

S. Yanev

Keyword(s):

Cytochrome P450 ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Qsar Analysis ◽