Reaction Details Report a problem with these data
Target
Cytochrome P450 2A13
Ligand
BDBM84689
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
7.6±0
Temperature
310.15±0 K
IC50
1.43e+5± 2.7e+4 nM
Citation
 Chougnet, A; Woggon, WD; Locher, E; Schilling, B Synthesis and in vitro activity of heterocyclic inhibitors of CYP2A6 and CYP2A13, two cytochrome P450 enzymes present in the respiratory tract. Chembiochem 10:1562-7 (2009) [PubMed]  Article 
Target
Name:
Cytochrome P450 2A13
Synonyms:
CP2AD_HUMAN | CYP2A13 | CYPIIA13 | Cytochrome P450 2A13 (CYP2A13)
Type:
Protein
Mol. Mass.:
56702.46
Organism:
Homo sapiens (Human)
Description:
Q16696
Residue:
494
Sequence:
MLASGLLLVTLLACLTVMVLMSVWRQRKSRGKLPPGPTPLPFIGNYLQLNTEQMYNSLMKISERYGPVFTIHLGPRRVVVLCGHDAVKEALVDQAEEFSGRGEQATFDWLFKGYGVAFSNGERAKQLRRFSIATLRGFGVGKRGIEERIQEEAGFLIDALRGTHGANIDPTFFLSRTVSNVISSIVFGDRFDYEDKEFLSLLRMMLGSFQFTATSTGQLYEMFSSVMKHLPGPQQQAFKELQGLEDFIAKKVEHNQRTLDPNSPRDFIDSFLIRMQEEEKNPNTEFYLKNLVMTTLNLFFAGTETVSTTLRYGFLLLMKHPEVEAKVHEEIDRVIGKNRQPKFEDRAKMPYTEAVIHEIQRFGDMLPMGLAHRVNKDTKFRDFFLPKGTEVFPMLGSVLRDPRFFSNPRDFNPQHFLDKKGQFKKSDAFVPFSIGKRYCFGEGLARMELFLFFTTIMQNFRFKSPQSPKDIDVSPKHVGFATIPRNYTMSFLPR
  
Inhibitor
Name:
BDBM84689
Synonyms:
2-Subsituted 1H-imidazole, 28
Type:
Small organic molecule
Emp. Form.:
C8H12N2
Mol. Mass.:
136.1943
SMILES:
CC\C=C\Cc1ncc[nH]1
Structure:
Search PDB for entries with ligand similarity: