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Target
Cytochrome P450 1A2
Ligand
BDBM50134771
Substrate
n/a
Meas. Tech.
ChEBML_1549435
IC50
3000±n/a nM
Citation
 Ammirati, M; Bagley, SW; Bhattacharya, SK; Buckbinder, L; Carlo, AA; Conrad, R; Cortes, C; Dow, RL; Dowling, MS; El-Kattan, A; Ford, K; Guimarães, CR; Hepworth, D; Jiao, W; LaPerle, J; Liu, S; Londregan, A; Loria, PM; Mathiowetz, AM; Munchhof, M; Orr, ST; Petersen, DN; Price, DA; Skoura, A; Smith, AC; Wang, J Discovery of an in Vivo Tool to Establish Proof-of-Concept for MAP4K4-Based Antidiabetic Treatment. ACS Med Chem Lett 6:1128-33 (2015) [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:
Human
Description:
P05177
Residue:
516
Sequence:
MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKNPHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDGQSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELMAGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFPILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGNLIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLSDRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPELWEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLEFSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN
  
Inhibitor
Name:
BDBM50134771
Synonyms:
CHEMBL3754515
Type:
Small organic molecule
Emp. Form.:
C16H13ClN4
Mol. Mass.:
296.754
SMILES:
Nc1ccc(cn1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
Structure:
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