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TargetCytochrome P450 2D6
LigandBDBM50325639
Substrate/Competitorn/a
Meas. Tech.ChEMBL_652285 (CHEMBL1225488)
IC50 600±n/a nM
Citation Lucas, MCWeikert, RJCarter, DSCai, HYGreenhouse, RIyer, PSLin, CJLee, EKMadera, AMMoore, AOzboya, KSchoenfeld, RCSteiner, SZhai, YLynch, SM Design, synthesis, and biological evaluation of new monoamine reuptake inhibitors with potential therapeutic utility in depression and pain. Bioorg Med Chem Lett20:5559-66 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cytochrome P450 2D6
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:
MGLEALVPLAVIVAIFLLLVDLMHRRQRWAARYPPGPLPLPGLGNLLHVDFQNTPYCFDQ
LRRRFGDVFSLQLAWTPVVVLNGLAAVREALVTHGEDTADRPPVPITQILGFGPRSQGVF
LARYGPAWREQRRFSVSTLRNLGLGKKSLEQWVTEEAACLCAAFANHSGRPFRPNGLLDK
AVSNVIASLTCGRRFEYDDPRFLRLLDLAQEGLKEESGFLREVLNAVPVLLHIPALAGKV
LRFQKAFLTQLDELLTEHRMTWDPAQPPRDLTEAFLAEMEKAKGNPESSFNDENLRIVVA
DLFSAGMVTTSTTLAWGLLLMILHPDVQRRVQQEIDDVIGQVRRPEMGDQAHMPYTTAVI
HEVQRFGDIVPLGVTHMTSRDIEVQGFRIPKGTTLITNLSSVLKDEAVWEKPFRFHPEHF
LDAQGHFVKPEAFLPFSAGRRACLGEPLARMELFLFFTSLLQHFSFSVPTGQPRPSHHGV
FAFLVSPSPYELCAVPR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50325639
n/a
NameBDBM50325639
Synonyms:(3-(3,3-dimethylbutyl)pyrrolidin-3-yl)(quinolin-2-yl)methanone | CHEMBL1224239
TypeSmall organic molecule
Emp. Form.C20H26N2O
Mol. Mass.310.4332
SMILESCC(C)(C)CCC1(CCNC1)C(=O)c1ccc2ccccc2n1
Structure
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