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Target
Cytochrome P450 3A4
Ligand
BDBM50335921
Substrate
n/a
Meas. Tech.
ChEMBL_717286 (CHEMBL1669909)
IC50
54200±n/a nM
Citation
 Tezuka, Y; Morikawa, K; Li, F; Auw, L; Awale, S; Nobukawa, T; Kadota, S Cytochrome P450 3A4 inhibitory constituents of the wood of Taxus yunnanensis. J Nat Prod 74:102-5 (2011) [PubMed]  Article 
Target
Name:
Cytochrome P450 3A4
Synonyms:
Albendazole monooxygenase | Albendazole sulfoxidase | CP3A4_HUMAN | CYP3A3 | CYP3A4 | CYPIIIA3 | CYPIIIA4 | Cytochrome P450 3A3 | Cytochrome P450 3A4 (CYP3A4) | Cytochrome P450 HLp | Nifedipine oxidase | Quinine 3-monooxygenase | Taurochenodeoxycholate 6-alpha-hydroxylase
Type:
Enzyme
Mol. Mass.:
57349.57
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
503
Sequence:
MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMFDMECHKKYGKVWGFYDGQQPVLAITDPDMIKTVLVKECYSVFTNRRPFGPVGFMKSAISIAEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYSMDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICVFPREVTNFLRKSVKRMKESRLEDTQKHRVDFLQLMIDSQNSKETESHKALSDLELVAQSIIFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVVNETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYALHRDPKYWTEPEKFLPERFSKKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLSLGGLLQPEKPVVLKVESRDGTVSGA
  
Inhibitor
Name:
BDBM50335921
Synonyms:
(7S,8S)-methoxy-3',7-epoxy-8,4'-oxyneoligna-4,9,9'-triol | CHEMBL1668115
Type:
Small organic molecule
Emp. Form.:
C19H22O6
Mol. Mass.:
346.3744
SMILES:
COc1cc(ccc1O)[C@@H]1Oc2cc(CCCO)ccc2O[C@H]1CO |r|
Structure:
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