A binary QSAR model for classification of hERG potassium channel blockers

Bioorganic and Medicinal Chemistry

Volumn 16, Issue 7, 2008, Pages 4107-4119

  Thai, Khac Minh ^a   Ecker, Gerhard F ^a  

^a UNIVERSITY OF VIENNA   (Austria)

Author keywords

Binary QSAR; GH score; hERG; Potassium channel; VSA descriptors

Indexed keywords

1 [2 (6 METHYL 2 PYRIDYL)ETHYL] 4 (4 METHYLSULFONYLAMINOBENZOYL)PIPERIDINE; ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR AGONIST; AMIODARONE; AMSACRINE; CHEMOKINE RECEPTOR ANTAGONIST; CHEMOKINE RECEPTOR CCR8 ANTAGONIST; CHLOROQUINE; CHLORPROMAZINE; CISAPRIDE; DESIPRAMINE; DIPEPTIDYL PEPTIDASE IV INHIBITOR; DOFETILIDE; DOLASETRON MESILATE; DOPAMINE D4 RECEPTOR ANTAGONIST; DOPAMINE RECEPTOR BLOCKING AGENT; FENTANYL; GRANISETRON; HALOPERIDOL; KETOCONAZOLE; LEUKOCYTE FUNCTION ASSOCIATED ANTIGEN 1 ANTAGONIST; LORATADINE; MEFLOQUINE; MELANIN CONCENTRATING HORMONE RECEPTOR 1 ANTAGONIST; NEUROKININ 1 RECEPTOR ANTAGONIST; NICOTINIC AGENT; OLANZAPINE; POTASSIUM CHANNEL BLOCKING AGENT; POTASSIUM CHANNEL HERG; TERFENADINE; UNCLASSIFIED DRUG; UNINDEXED DRUG;

ALGORITHM; ARTICLE; DRUG CLASSIFICATION; DRUG SCREENING; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

ANIMALS; CELL LINE; CERCOPITHECUS AETHIOPS; CRICETINAE; ETHER-A-GO-GO POTASSIUM CHANNELS; HUMANS; MODELS, BIOLOGICAL; MOLECULAR STRUCTURE; POTASSIUM CHANNEL BLOCKERS; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 41649121041     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2008.01.017     Document Type: Article

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