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Target
Cytochrome P450 2D6
Ligand
BDBM50204020
Substrate
n/a
Meas. Tech.
ChEMBL_1677411 (CHEMBL4027554)
IC50
>60000±n/a nM
Citation
 Hamdouchi, C; Maiti, P; Warshawsky, AM; DeBaillie, AC; Otto, KA; Wilbur, KL; Kahl, SD; Patel Lewis, A; Cardona, GR; Zink, RW; Chen, K; Cr, S; Lineswala, JP; Neathery, GL; Bouaichi, C; Diseroad, BA; Campbell, AN; Sweetana, SA; Adams, LA; Cabrera, O; Ma, X; Yumibe, NP; Montrose-Rafizadeh, C; Chen, Y; Miller, AR Discovery of LY3104607: A Potent and Selective G Protein-Coupled Receptor 40 (GPR40) Agonist with Optimized Pharmacokinetic Properties to Support Once Daily Oral Treatment in Patients with Type 2 Diabetes Mellitus. J Med Chem 61:934-945 (2018) [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:
BDBM50204020
Synonyms:
CHEMBL3927519
Type:
Small organic molecule
Emp. Form.:
C27H25N3O3
Mol. Mass.:
439.5057
SMILES:
CC#C[C@@H](CC(O)=O)c1ccc(OCc2ccc3nc(nn3c2)-c2c(C)cccc2C)cc1 |r|
Structure:
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