Metabolizer specifications


Unique identifier OMICS_15734
Name Metabolizer
Software type Package/Module
Interface Command line interface, Graphical user interface
Restrictions to use License purchase required
Operating system Unix/Linux, Mac OS, Windows
Computer skills Advanced
Stability No
Maintained No


No version available

Metabolizer citation


Functioning of drug metabolizing microsomal cytochrome P450s: In silico probing of proteins suggests that the distal heme ‘active site’ pocket plays a relatively ‘passive role’ in some enzyme substrate interactions

PMCID: 4760962
PMID: 26894412
DOI: 10.1186/s40203-016-0016-7

[…] crystal structure showed two molecules docked within the heme distal pocket (). When compared to the drug metabolism data, the crystal structures do not make much sense because Ketoconazole’s primary metabolizer is CYP3A4 (Fitch et al. ). Clotrimazole, a facile one-electron redox active molecule, could even alter the redox status within the microenvironment by directly interacting with superoxide/ […]

Metabolizer institution(s)
ChemAxon Ltd., Budapest, Hungary

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