Virtual screening-driven identification of human carbonic anhydrase inhibitors incorporating an original, new pharmacophore

Bioorganic and Medicinal Chemistry Letters

Volumn 21, Issue 8, 2011, Pages 2515-2520

  Pala, Nicolino ^a   Dallocchio, Roberto ^b   Dessì, Alessandro ^b   Brancale, Andrea ^c   Carta, Fabrizio ^d   Ihm, Simone ^a   Maresca, Alfonso ^d   Sechi, Mario ^a   Supuran, Claudiu T ^d  

^a UNIVERSITY OF SASSARI   (Italy)

^b CNR   (Italy)

^c CARDIFF UNIVERSITY   (United Kingdom)

^d UNIVERSITY OF FLORENCE   (Italy)

Author keywords

CA inhibitors; Human carbonic anhydrase; Virtual screening

Indexed keywords

ACETAZOLAMIDE; ACETONE; CARBONATE DEHYDRATASE; CARBONATE DEHYDRATASE I; CARBONATE DEHYDRATASE II; CARBONATE DEHYDRATASE INHIBITOR; FLUORINE DERIVATIVE; LIGAND; SULFONAMIDE;

ARTICLE; CRYSTAL STRUCTURE; DRUG SCREENING; DRUG SELECTIVITY; ENZYME ACTIVE SITE; ENZYME INHIBITION; MOLECULAR DOCKING; PHARMACOPHORE; STEREOCHEMISTRY;

TRIFLUORO;

EID: 84944964274     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2011.02.059     Document Type: Article

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