Reaction Details  Report a problem with these data
Target
Cytochrome P450 2D4
Ligand
BDBM50426305
Substrate
n/a
Meas. Tech.
ChEMBL_939580 (CHEMBL2328464)
IC50
>100000±n/a nM
Citation
 Maurya, R; Soni, A; Anand, D; Ravi, M; Raju, KS; Taneja, I; Naikade, NK; Puri, SK; Wahajuddin, na; Kanojiya, S; Yadav, PP Synthesis and antimalarial activity of 3,3-spiroanellated 5,6-disubstituted 1,2,4-trioxanes. ACS Med Chem Lett 4:165-9 (2013) [PubMed]  Article
Target
Name:
Cytochrome P450 2D4
Synonyms:
CP2D4_RAT | CYPIID4 | Cyp2d-18 | Cyp2d-4 | Cyp2d18 | Cyp2d4 | Cytochrome P450 2D18 | Cytochrome P450 2D4 | Cytochrome P450-CMF3 | Cytochrome P450-DB4 | Debrisoquine 4-hydroxylase
Type:
PROTEIN
Mol. Mass.:
56689.73
Organism:
Rattus norvegicus
Description:
ChEMBL_1280215
Residue:
500
Sequence:
MRMPTGSELWPIAIFTIIFLLLVDLMHRRQRWTSRYPPGPVPWPVLGNLLQIDFQNMPAGFQKLRCRFGDLFSLQLAFESVVVLNGLPALREALVKYSEDTADRPPLHFNDQSGFGPRSQGVVLARYGPAWRQQRRFSVSTFRHFGLGKKSLEQWVTEEARCLCAAFADHSGFPFSPNTLLDKAVCNVIASLLFACRFEYNDPRFIRLLDLLKDTLEEESGFLPMLLNVFPMLLHIPGLLGKVFSGKKAFVAMLDELLTEHKVTWDPAQPPRDLTDAFLAEVEKAKGNPESSFNDENLRVVVADLFMAGMVTTSTTLTWALLFMILRPDVQCRVQQEIDEVIGQVRRPEMADQARMPFTNAVIHEVQRFADILPLGVPHKTSRDIEVQGFLIPKGTTLIINLSSVLKDETVWEKPLRFHPEHFLDAQGNFVKHEAFMPFSAGRRACLGEPLARMELFLFFTCLLQRFSFSVPAGQPRPSNYGVFGALTTPRPYQLCASPR
  
Inhibitor
Name:
BDBM50426305
Synonyms:
ARTEMOTIL
Type:
Small organic molecule
Emp. Form.:
C17H28O5
Mol. Mass.:
312.4012
SMILES:
CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 |r|
Structure:
Search PDB for entries with ligand similarity: