Class II-selective histone deacetylase inhibitors. Part 2: Alignment-independent GRIND 3-D QSAR, homology and docking studies

European Journal of Medicinal Chemistry

Volumn 43, Issue 3, 2008, Pages 621-632

  Ragno, Rino ^a   Simeoni, Silvia ^a   Rotili, Dante ^a   Caroli, Antonella ^a   Botta, Giorgia ^a   Brosch, Gerald ^b   Massa, Silvio ^c   Mai, Antonello ^a  

^a SAPIENZA UNIVERSITY OF ROME   (Italy)

^b INNSBRUCK MEDICAL UNIVERSITY   (Austria)

^c UNIVERSITY OF SIENA   (Italy)

Author keywords

3 D QSAR; ALMOND; Class selectivity; GRIND descriptors; HDAC inhibitors; Histone deacetylation

Indexed keywords

HISTONE DEACETYLASE 2; HISTONE DEACETYLASE INHIBITOR;

ARTICLE; CRYSTAL STRUCTURE; DRUG ACTIVITY; DRUG SELECTIVITY; DRUG STRUCTURE; DRUG SYNTHESIS; STRUCTURE ACTIVITY RELATION;

DRUG DESIGN; ENZYME INHIBITORS; HISTONE DEACETYLASES; HYDROXAMIC ACIDS; INHIBITORY CONCENTRATION 50; MODELS, MOLECULAR; MOLECULAR CONFORMATION; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; SEQUENCE HOMOLOGY, AMINO ACID; SOFTWARE; SUBSTRATE SPECIFICITY; ZEA MAYS;

EID: 40049110686     PISSN: 02235234     EISSN: 17683254     Source Type: Journal    
DOI: 10.1016/j.ejmech.2007.05.004     Document Type: Article

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