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Chemometric approach to a QSAR study of peptides behaving as NK-2 receptor antagonists

โœ Scribed by Sergio Clementi; Gabriele Cruciani; Daniela Riganelli; Paolo Rovero; Vittorio Pestellini; Carlo Alberto Maggi; Massimo Baroni


Book ID
103931851
Publisher
Elsevier Science
Year
1990
Weight
578 KB
Volume
3
Category
Article
ISSN
0898-5529

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โœฆ Synopsis


This paper shows the advantages of using chemometric strategies in QSAR of NKA analogues containing D-Tryptophan and behaving as highly selective NK-2 receptor antagonists: a) detecting the sequence with optimal antagonist activity, and b) having a strategy for selecting a few most informative sequences. The data set is included on disk as RVD.DAT.


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QSAR study of 2,4-disubstituted phenoxya
โœ Abhishek K. Jain; Veerasamy Ravichandran; Rajesh Singh; Vishnukanth Mourya; Ram ๐Ÿ“‚ Article ๐Ÿ“… 2009 ๐Ÿ› Versita ๐ŸŒ English โš– 359 KB

## Abstract In pursuit of better CRTh2 receptor antagonist agents, QSAR studies were performed on a series of 2,4-disubstituted phenoxyacetic acid derivatives. Stepwise multiple linear regression analysis was performed to derive QSAR models which were further evaluated for statistical significance