Reaction Details  Report a problem with these data
Target
Cytochrome P450 2D6
Ligand
BDBM388482
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
230±n/a nM
Citation
 Richelson, E; Fauq, AH; Carlier, P; Monceaux, CJ Inhibiting neurotransmitter reuptake US Patent  US9944618 Publication Date 4/17/2018
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:
BDBM388482
Synonyms:
US9944618, Compound ID No. 16
Type:
Small organic molecule
Emp. Form.:
C16H17BrClNO
Mol. Mass.:
354.669
SMILES:
CNCC([C@H](O)c1ccccc1)c1ccc(Br)c(Cl)c1 |r|
Structure:
Search PDB for entries with ligand similarity: