Activity Profile Sequences: a Concept to Account for the Progression of Compound Activity in Target Space and to Extract SAR Information from Analogue Series with Multiple Target Annotations | Zendy

Hu Ye | Zendy; Bajorath Jürgen | Zendy

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Activity Profile Sequences: a Concept to Account for the Progression of Compound Activity in Target Space and to Extract SAR Information from Analogue Series with Multiple Target Annotations

Author(s) -

Hu Ye,

Bajorath Jürgen

Publication year - 2011

Publication title -

chemmedchem

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.817

H-Index - 100

eISSN - 1860-7187

pISSN - 1860-7179

DOI - 10.1002/cmdc.201100395

Subject(s) - series (stratigraphy) , space (punctuation) , sequence (biology) , computer science , information retrieval , chemical space , computational biology , biology , bioinformatics , drug discovery , genetics , paleontology , operating system

Progression of compound activity in target space: We introduce the concept of activity profile sequences to organize compound series into sets of structures active against stepwise increasing numbers of targets. Shown is an exemplary sequence containing a conserved scaffold representing compounds with activity against up to four targets (A–D).

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