Novel inhibitors of trihydroxynaphthalene reductase with antifungal activity identified by ligand-based and structure-based virtual screening

Journal of Chemical Information and Modeling

Volumn 51, Issue 7, 2011, Pages 1716-1724

  Brunskole Švegelj, Mojca ^a   Turk, Samo ^b   Brus, Boris ^b   Lanišnik Rižner, Tea ^a   Stojan, Jure ^a   Gobec, Stanislav ^b  

^a UNIVERSITY OF LJUBLJANA   (Slovenia)

^b UNIVERSITY OF LJUBLJANA   (Slovenia)

Author keywords

[No Author keywords available]

Indexed keywords

LIGANDS;

ANTI-FUNGAL ACTIVITY; BIOSYNTHETIC PATHWAY; DARK-PIGMENTED FUNGI; DIHYDROXYNAPHTHALENES; NANOMOLAR CONCENTRATION; SIMILARITY SEARCHING; VIRTUAL SCREENING; VIRULENCE FACTORS;

DIAGNOSIS;

ANTIFUNGAL AGENT; FUNGAL PROTEIN; LIGAND; OXIDOREDUCTASE; TETRAHYDROXYNAPHTHALENE REDUCTASE;

ARTICLE; BINDING COMPETITION; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; DRUG ANTAGONISM; HIGH THROUGHPUT SCREENING; MOLECULAR LIBRARY; STRUCTURE ACTIVITY RELATION;

ANTIFUNGAL AGENTS; BINDING, COMPETITIVE; COMPUTER SIMULATION; FUNGAL PROTEINS; HIGH-THROUGHPUT SCREENING ASSAYS; LIGANDS; MOLECULAR STRUCTURE; OXIDOREDUCTASES ACTING ON CH-CH GROUP DONORS; SMALL MOLECULE LIBRARIES; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 79960707810     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci2001499     Document Type: Article

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