Reaction Details Report a problem with these data
Target
Cytochrome P450 2D6
Ligand
BDBM50386200
Substrate
n/a
Meas. Tech.
ChEMBL_824339 (CHEMBL2044629)
IC50
106000±n/a nM
Citation
 Louvet, P; Schweizer, D; Gourdel, ME; Riguet, E; Yue, C; Marcy, VR; Lin, YG; Gruner, J; Lesur, B; Bacon, ER; Chatterjee, S Wake-promoting agents: search for next generation modafinil: part IV. Eur J Med Chem 54:949-51 (2012) [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:
BDBM50386200
Synonyms:
CHEMBL2043240
Type:
Small organic molecule
Emp. Form.:
C15H13Cl2NO3S
Mol. Mass.:
358.24
SMILES:
NC(=O)CS(=O)Cc1ccccc1Oc1ccc(Cl)c(Cl)c1
Structure:
Search PDB for entries with ligand similarity: