Reaction Details Report a problem with these data
Target
Squalene synthase
Ligand
BDBM50253493
Substrate
n/a
Meas. Tech.
ChEMBL_512553 (CHEMBL967864)
IC50
3000±n/a nM
Citation
 Kourounakis, AP; Charitos, C; Rekka, EA; Kourounakis, PN Lipid-lowering (hetero)aromatic tetrahydro-1,4-oxazine derivatives with antioxidant and squalene synthase inhibitory activity. J Med Chem 51:5861-5 (2008) [PubMed]  Article 
Target
Name:
Squalene synthase
Synonyms:
FDFT_RAT | FPP:FPP farnesyltransferase | Farnesyl-diphosphate farnesyltransferase | Fdft1 | SQS | SS | Squalene synthetase
Type:
PROTEIN
Mol. Mass.:
48109.41
Organism:
Rattus norvegicus
Description:
ChEMBL_1336736
Residue:
416
Sequence:
MEFVKCLGHPEEFYNLLRFRMGGRRNFIPKMDRNSLSNSLKTCYKYLDQTSRSFAAVIQALDGDIRHAVCVFYLILRAMDTVEDDMAISVEKKIPLLRNFHTFLYEPEWRFTESKEKHRVVLEDFPTISLEFRNLAEKYQTVIADICHRMGCGMAEFLNKDVTSKQDWDKYCHYVAGLVGIGLSRLFSASEFEDPIVGEDTECANSMGLFLQKTNIIRDYLEDQQEGRQFWPQEVWGKYVKKLEDFVKPENVDVAVKCLNELITNALQHIPDVITYLSRLRNQSVFNFCAIPQVMAIATLAACYNNHQVFKGVVKIRKGQAVTLMMDATNMPAVKAIIYQYIEEIYHRVPNSDPSASKAKQLISNIRTQSLPNCQLISRSHYSPIYLSFIMLLAALSWQYLSTLSQVTEDYVQREH
  
Inhibitor
Name:
BDBM50253493
Synonyms:
3-[4-(4-Bromophenyl)phenyl]-octahydro-1,4-pyrido[2,1-c]oxazine-3-ol | CHEMBL494913
Type:
Small organic molecule
Emp. Form.:
C20H22BrNO2
Mol. Mass.:
388.298
SMILES:
OC1(CN2CCCCC2CO1)c1ccc(cc1)-c1ccc(Br)cc1
Structure:
Search PDB for entries with ligand similarity: