Reaction Details Report a problem with these data
Target
Cytochrome P450 1A2
Ligand
BDBM50259585
Substrate
n/a
Meas. Tech.
ChEMBL_500938 (CHEMBL971453)
IC50
>10000±n/a nM
Citation
 Clutterbuck, LA; Posada, CG; Visintin, C; Riddall, DR; Lancaster, B; Gane, PJ; Garthwaite, J; Selwood, DL Oxadiazolylindazole sodium channel modulators are neuroprotective toward hippocampal neurones. J Med Chem 52:2694-707 (2009) [PubMed]  Article 
Target
Name:
Cytochrome P450 1A2
Synonyms:
CP1A2_HUMAN | CYP1A2 | CYPIA2 | Cholesterol 25-hydroxylase | Cytochrome P(3)450 | Cytochrome P450 1A | Cytochrome P450 1A2 (CYP1A2) | Cytochrome P450 4 | Cytochrome P450-P3
Type:
Enzyme
Mol. Mass.:
58423.38
Organism:
Homo sapiens (Human)
Description:
P05177
Residue:
516
Sequence:
MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKNPHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDGQSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELMAGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFPILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGNLIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLSDRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPELWEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLEFSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN
  
Inhibitor
Name:
BDBM50259585
Synonyms:
(5-(1-(3,4-Dimethoxyphenylsulfonyl)-1H-indazol-3-yl)-1,2,4-oxadiazol-3-yl)methanamine | CHEMBL511924
Type:
Small organic molecule
Emp. Form.:
C18H17N5O5S
Mol. Mass.:
415.423
SMILES:
COc1ccc(cc1OC)S(=O)(=O)n1nc(-c2nc(CN)no2)c2ccccc12
Structure:
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