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TargetSqualene synthase
LigandBDBM50052374
Substrate/Competitorn/a
Meas. Tech.ChEMBL_202113 (CHEMBL808971)
IC50 270±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:
BDBM50052374
n/a
NameBDBM50052374
Synonyms:3-(4-Pyridin-3-yl-phenyl)-1-aza-bicyclo[2.2.2]octan-3-ol | CHEMBL322664
TypeSmall organic molecule
Emp. Form.C18H20N2O
Mol. Mass.280.3642
SMILESOC1(CN2CCC1CC2)c1ccc(cc1)-c1cccnc1 |TLB:9:1:5.4:7.8,0:1:5.4:7.8,(12.97,-8.1,;12.85,-10.02,;13.14,-11.51,;11.67,-10.84,;11.95,-8.79,;11.39,-7.51,;11.39,-9.36,;9.81,-10.05,;10.02,-11.54,;14.39,-10.04,;15.16,-11.36,;16.68,-11.36,;17.45,-10.04,;16.68,-8.7,;15.16,-8.7,;19,-10.02,;19.76,-8.7,;21.3,-8.7,;22.07,-10.02,;21.3,-11.36,;19.76,-11.37,)|
Structure
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