scholarly journals Synthesis and Quantitative Structure−Activity Relationship of Fatty Acid Amide Hydrolase Inhibitors: Modulation at the N-Portion of Biphenyl-3-yl Alkylcarbamates

2008 ◽  
Vol 51 (12) ◽  
pp. 3487-3498 ◽  
Author(s):  
Marco Mor ◽  
Alessio Lodola ◽  
Silvia Rivara ◽  
Federica Vacondio ◽  
Andrea Duranti ◽  
...  
Keyword(s):  
Fatty Acid ◽  
Fatty Acid Amide Hydrolase ◽  
Acid Amide ◽  
Quantitative Structure Activity Relationship ◽  
Activity Relationship ◽  
Quantitative Structure ◽  
Structure Activity ◽  
Amide Hydrolase ◽  
Relationship Of ◽  
Fatty Acid Amide

Structure−Activity Relationship of a Series of Inhibitors of Monoacylglycerol HydrolysisComparison with Effects upon Fatty Acid Amide Hydrolase†

2007 ◽  
Vol 50 (20) ◽  
pp. 5012-5023 ◽  
Author(s):  
José Antonio Cisneros ◽  
Séverine Vandevoorde ◽  
Silvia Ortega-Gutiérrez ◽  
Clément Paris ◽  
Christopher J. Fowler ◽  
...  
Keyword(s):  
Fatty Acid ◽  
Fatty Acid Amide Hydrolase ◽  
Acid Amide ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Structure Activity ◽  
Amide Hydrolase ◽  
Relationship Of ◽  
Fatty Acid Amide

scholarly journals Synthesis and Structure–Activity Relationship Studies ofO-Biphenyl-3-yl Carbamates as Peripherally Restricted Fatty Acid Amide Hydrolase Inhibitors

2013 ◽  
Vol 56 (14) ◽  
pp. 5917-5930 ◽  
Author(s):  
Guillermo Moreno-Sanz ◽  
Andrea Duranti ◽  
Laurin Melzig ◽  
Claudio Fiorelli ◽  
Gian Filippo Ruda ◽  
...  
Keyword(s):  
Fatty Acid ◽  
Fatty Acid Amide Hydrolase ◽  
Acid Amide ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Structure Activity ◽  
Amide Hydrolase ◽  
Fatty Acid Amide

scholarly journals Three-Dimensional Quantitative Structure-Activity Relationships (3D-QSAR) on a Series of Piperazine-Carboxamides Fatty Acid Amide Hydrolase (FAAH) Inhibitors as a Useful Tool for the Design of New Cannabinoid Ligands

2019 ◽  
Vol 20 (10) ◽  
pp. 2510 ◽  
Author(s):  
Lorca ◽  
Valdes ◽  
Chung ◽  
Romero-Parra ◽  
Pessoa-Mahana ◽  
...  
Keyword(s):  
Fatty Acid ◽  
Fatty Acid Amide Hydrolase ◽  
Acid Amide ◽  
Three Dimensional ◽  
3D Qsar ◽  
Quantitative Structure ◽  
Structure Activity ◽  
Quantitative Structure Activity Relationships ◽  
Amide Hydrolase ◽  
Fatty Acid Amide

Fatty Acid Amide Hydrolase (FAAH) is one of the main enzymes responsible for endocannabinoid metabolism. Inhibition of FAAH increases endogenous levels of fatty acid ethanolamides such as anandamide (AEA) and thus consitutes an indirect strategy that can be used to modulate endocannabinoid tone. In the present work, we present a three-dimensional quantitative structure-activity relationships/comparative molecular similarity indices analysis (3D-QSAR/CoMSIA) study on a series of 90 reported irreversible inhibitors of FAAH sharing a piperazine-carboxamide scaffold. The model obtained was extensively validated (q2 = 0.734; r2 = 0.966; r2m = 0.723). Finally, based on the information derived from the contour maps we designed a series of 10 new compounds with high predicted FAAH inhibition (predicted pIC50 of the best-proposed compounds = 12.196; 12.416).

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