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Target
Cytochrome P450 3A4
Ligand
BDBM50175839
Substrate
n/a
Meas. Tech.
ChEMBL_334185 (CHEMBL867137)
IC50
>20000±n/a nM
Citation
 Berlin, M; Ting, PC; Vaccaro, WD; Aslanian, R; McCormick, KD; Lee, JF; Albanese, MM; Mutahi, MW; Piwinski, JJ; Shih, NY; Duguma, L; Solomon, DM; Zhou, W; Sher, R; Favreau, L; Bryant, M; Korfmacher, WA; Nardo, C; West, RE; Anthes, JC; Williams, SM; Wu, RL; Susan She, H; Rivelli, MA; Corboz, MR; Hey, JA Reduction of CYP450 inhibition in the 4-[(1H-imidazol-4-yl)methyl]piperidine series of histamine H3 receptor antagonists. Bioorg Med Chem Lett 16:989-94 (2006) [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:
BDBM50175839
Synonyms:
4-((1H-imidazol-4-yl)methyl)-1-(3-phenoxypropyl)piperidine | CHEMBL200267
Type:
Small organic molecule
Emp. Form.:
C18H25N3O
Mol. Mass.:
299.4106
SMILES:
C(COc1ccccc1)CN1CCC(Cc2cnc[nH]2)CC1
Structure:
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