Reaction Details Report a problem with these data
Target
Cytochrome P450 2D6
Ligand
BDBM50443214
Substrate
n/a
Meas. Tech.
ChEMBL_1276540 (CHEMBL3088767)
IC50
>27000±n/a nM
Citation
 Chen, JJ; Qian, W; Biswas, K; Yuan, C; Amegadzie, A; Liu, Q; Nixey, T; Zhu, J; Ncube, M; Rzasa, RM; Chavez, F; Chen, N; DeMorin, F; Rumfelt, S; Tegley, CM; Allen, JR; Hitchcock, S; Hungate, R; Bartberger, MD; Zalameda, L; Liu, Y; McCarter, JD; Zhang, J; Zhu, L; Babu-Khan, S; Luo, Y; Bradley, J; Wen, PH; Reid, DL; Koegler, F; Dean, C; Hickman, D; Correll, TL; Williamson, T; Wood, S Discovery of 2-methylpyridine-based biaryl amides as¿-secretase modulators for the treatment of Alzheimer's disease. Bioorg Med Chem Lett 23:6447-54 (2013) [PubMed]  Article 
Target
Name:
Cytochrome P450 2D6
Synonyms:
CP2D6_HUMAN | CYP2D6 | CYP2DL1 | CYPIID6 | Cytochrome P450 2D6 (CYP2D6) | Debrisoquine 4-hydroxylase | P450-DB1
Type:
Protein
Mol. Mass.:
55774.82
Organism:
Homo sapiens (Human)
Description:
P10635
Residue:
497
Sequence:
MGLEALVPLAVIVAIFLLLVDLMHRRQRWAARYPPGPLPLPGLGNLLHVDFQNTPYCFDQLRRRFGDVFSLQLAWTPVVVLNGLAAVREALVTHGEDTADRPPVPITQILGFGPRSQGVFLARYGPAWREQRRFSVSTLRNLGLGKKSLEQWVTEEAACLCAAFANHSGRPFRPNGLLDKAVSNVIASLTCGRRFEYDDPRFLRLLDLAQEGLKEESGFLREVLNAVPVLLHIPALAGKVLRFQKAFLTQLDELLTEHRMTWDPAQPPRDLTEAFLAEMEKAKGNPESSFNDENLRIVVADLFSAGMVTTSTTLAWGLLLMILHPDVQRRVQQEIDDVIGQVRRPEMGDQAHMPYTTAVIHEVQRFGDIVPLGVTHMTSRDIEVQGFRIPKGTTLITNLSSVLKDEAVWEKPFRFHPEHFLDAQGHFVKPEAFLPFSAGRRACLGEPLARMELFLFFTSLLQHFSFSVPTGQPRPSHHGVFAFLVSPSPYELCAVPR
  
Inhibitor
Name:
BDBM50443214
Synonyms:
CHEMBL3087348
Type:
Small organic molecule
Emp. Form.:
C16H11Cl2NO3S
Mol. Mass.:
368.234
SMILES:
Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc(cc1)-c1ccco1
Structure:
Search PDB for entries with ligand similarity: