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Target
Cytochrome P450 2D6
Ligand
BDBM50321339
Substrate
n/a
Meas. Tech.
ChEMBL_640168 (CHEMBL1174568)
IC50
700±n/a nM
Citation
 Carter, DS; Cai, HY; Lee, EK; Iyer, PS; Lucas, MC; Roetz, R; Schoenfeld, RC; Weikert, RJ 2-Substituted N-aryl piperazines as novel triple reuptake inhibitors for the treatment of depression. Bioorg Med Chem Lett 20:3941-5 (2010) [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:
BDBM50321339
Synonyms:
5-(2-(ethoxymethyl)piperazin-1-yl)-1H-indazole | CHEMBL1170213
Type:
Small organic molecule
Emp. Form.:
C14H20N4O
Mol. Mass.:
260.3348
SMILES:
CCOCC1CNCCN1c1ccc2[nH]ncc2c1
Structure:
Search PDB for entries with ligand similarity: