Amino substituted nitrogen heterocycle ureas as kinase insert domain containing receptor (KDR) inhibitors: Performance of structure–activity relationship approaches

Amino substituted nitrogen heterocycle ureas as kinase insert domain containing receptor (KDR) inhibitors: Performance of structure–activity relationship approaches

A quantitative structure–activity relationship (QSAR) study was performed on a set of amino-substituted nitrogen heterocyclic urea derivatives. Two novel approaches were applied: (1) the simplified molecular input-line entry systems (SMILES) based optimal descriptors approach; and (2) the fragment-b...

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Bibliographic Details
Main Authors: Hayriye Yilmaz, Natalia Sizochenko, Bakhtiyor Rasulev, Andrey Toropov, Yahya Guzel, Viktor Kuz'min, Danuta Leszczynska, Jerzy Leszczynski
Format: Article
Language:English
Published: Elsevier 2015-06-01
Series:Journal of Food and Drug Analysis
Subjects:
amino-substituted nitrogen heterocyclic ureas
descriptors
KDR inhibitors
QSAR
SiRMS
SMILES
Online Access:http://www.sciencedirect.com/science/article/pii/S1021949815000435

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http://www.sciencedirect.com/science/article/pii/S1021949815000435

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