Reaction Details Report a problem with these data
Target
Squalene monooxygenase
Ligand
BDBM50032837
Substrate
n/a
Meas. Tech.
ChEMBL_201941 (CHEMBL809128)
IC50
70±n/a nM
Citation
Gotteland, JP; Brunel, I; Gendre, F; Désiré, J; Delhon, A; Junquéro, D; Oms, P; Halazy, S (Aryloxy)methylsilane derivatives as new cholesterol biosynthesis inhibitors: synthesis and hypocholesterolemic activity of a new class of squalene epoxidase inhibitors. J Med Chem 38:3207-16 (1995) [PubMed] Article
More Info.:
Target
Name:
Squalene monooxygenase
Synonyms:
ERG1 | ERG1_HUMAN | SE | SQLE | Squalene epoxidase
Type:
PROTEIN
Mol. Mass.:
63936.94
Organism:
Homo sapiens (Human)
Description:
ChEMBL_201924
Residue:
574
Sequence:
MWTFLGIATFTYFYKKFGDFITLANREVLLCVLVFLSLGLVLSYRCRHRNGGLLGRQQSGSQFALFSDILSGLPFIGFFWAKSPPESENKEQLEARRRRKGTNISETSLIGTAACTSTSSQNDPEVIIVGAGVLGSALAAVLSRDGRKVTVIERDLKEPDRIVGEFLQPGGYHVLKDLGLGDTVEGLDAQVVNGYMIHDQESKSEVQIPYPLSENNQVQSGRAFHHGRFIMSLRKAAMAEPNAKFIEGVVLQLLEEDDVVMGVQYKDKETGDIKELHAPLTVVADGLFSKFRKSLVSNKVSVSSHFVGFLMKNAPQFKANHAELILANPSPVLIYQISSSETRVLVDIRGEMPRNLREYMVEKIYPQIPDHLKEPFLEATDNSHLRSMPASFLPPSSVKKRGVLLLGDAYNMRHPLTGGGMTVAFKDIKLWRKLLKGIPDLYDDAAIFEAKKSFYWARKTSHSFVVNILAQALYELFSATDDSLHQLRKACFLYFKLGGECVAGPVGLLSVLSPNPLVLIGHFFAVAIYAVYFCFKSEPWITKPRALLSSGAVLYKACSVIFPLIYSEMKYMVH
Inhibitor
Name:
BDBM50032837
Synonyms:
((E)-6,6-Dimethyl-hept-2-en-4-ynyl)-(3-{[dimethyl-(4-vinyl-phenyl)-silanyl]-methoxy}-benzyl)-ethyl-amine | CHEMBL107608
Type:
Small organic molecule
Emp. Form.:
C29H39NOSi
Mol. Mass.:
445.7116
SMILES:
CCN(C\C=C\C#CC(C)(C)C)Cc1cccc(OC[Si](C)(C)c2ccc(C=C)cc2)c1