Mining for bioactive scaffolds with scaffold networks: Improved compound set enrichment from primary screening data

Journal of Chemical Information and Modeling

Volumn 51, Issue 7, 2011, Pages 1528-1538

  Varin, Thibault ^a   Schuffenhauer, Ansgar ^a   Ertl, Peter ^a   Renner, Steffen ^a  

^a NOVARTIS PHARMA AG   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

AIR NAVIGATION; TREES (MATHEMATICS);

BIOACTIVE SCAFFOLD; CHEMICAL AND BIOLOGICALS; CHEMICAL PATTERN; EXHAUSTIVE ENUMERATION; HIGH THROUGHPUT; MOLECULAR SCAFFOLDS; PRIMARY SCREENING; TREE-BASED APPROACH;

SCAFFOLDS;

SEROTONIN 3 ANTAGONIST;

ARTICLE; BIOLOGICAL MODEL; BIOLOGY; CHEMICAL STRUCTURE; CHEMISTRY; DRUG DEVELOPMENT; HIGH THROUGHPUT SCREENING; MOLECULAR LIBRARY;

COMPUTATIONAL BIOLOGY; DRUG DISCOVERY; HIGH-THROUGHPUT SCREENING ASSAYS; MODELS, BIOLOGICAL; MODELS, MOLECULAR; MOLECULAR STRUCTURE; SEROTONIN 5-HT3 RECEPTOR ANTAGONISTS; SMALL MOLECULE LIBRARIES;

EID: 79960743954     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci2000924     Document Type: Article

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