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TargetSqualene synthase
LigandBDBM50052365
Substrate/Competitorn/a
Meas. Tech.ChEMBL_202113 (CHEMBL808971)
IC50>2500±n/a nM
Citation Brown, GRClarke, DSFoubister, AJFreeman, SHarrison, PJJohnson, MCMallion, KBMcCormick, JMcTaggart, FReid, ACSmith, GJTaylor, MJ Synthesis and activity of a novel series of 3-biarylquinuclidine squalene synthase inhibitors. J Med Chem39:2971-9 (1996) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Squalene synthase
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:
MEFVKCLGHPEEFYNLLRFRMGGRRNFIPKMDRNSLSNSLKTCYKYLDQTSRSFAAVIQA
LDGDIRHAVCVFYLILRAMDTVEDDMAISVEKKIPLLRNFHTFLYEPEWRFTESKEKHRV
VLEDFPTISLEFRNLAEKYQTVIADICHRMGCGMAEFLNKDVTSKQDWDKYCHYVAGLVG
IGLSRLFSASEFEDPIVGEDTECANSMGLFLQKTNIIRDYLEDQQEGRQFWPQEVWGKYV
KKLEDFVKPENVDVAVKCLNELITNALQHIPDVITYLSRLRNQSVFNFCAIPQVMAIATL
AACYNNHQVFKGVVKIRKGQAVTLMMDATNMPAVKAIIYQYIEEIYHRVPNSDPSASKAK
QLISNIRTQSLPNCQLISRSHYSPIYLSFIMLLAALSWQYLSTLSQVTEDYVQREH
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  Blast E-value cutoff:
BDBM50052365
n/a
NameBDBM50052365
Synonyms:3-Biphenyl-4-yl-3-methoxy-1-aza-bicyclo[2.2.2]octane | CHEMBL102188
TypeSmall organic molecule
Emp. Form.C20H23NO
Mol. Mass.293.4027
SMILESCOC1(CN2CCC1CC2)c1ccc(cc1)-c1ccccc1 |THB:10:2:6.5:8.9,1:2:6.5:8.9,(12.8,-6.52,;11.68,-7.17,;11.5,-9.25,;11.79,-10.63,;10.41,-10.01,;8.89,-10.66,;8.69,-9.28,;10.15,-8.64,;10.15,-6.94,;10.66,-8.12,;13.04,-9.25,;13.81,-7.92,;15.35,-7.92,;16.12,-9.25,;15.35,-10.6,;13.81,-10.6,;17.66,-9.25,;18.43,-10.59,;19.97,-10.59,;20.74,-9.25,;19.97,-7.9,;18.43,-7.92,)|
Structure
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