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TargetSqualene synthase
LigandBDBM50052369
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:
BDBM50052369
n/a
NameBDBM50052369
Synonyms:(1-Aza-bicyclo[2.2.2]oct-3-yl)-biphenyl-4-yl-methanol | CHEMBL101863
TypeSmall organic molecule
Emp. Form.C20H23NO
Mol. Mass.293.4027
SMILESOC(C1CN2CCC1CC2)c1ccc(cc1)-c1ccccc1 |TLB:1:2:8.9:6.5,(13.02,-8,;13.53,-9.45,;12.32,-10.4,;12.62,-11.9,;11.14,-11.23,;11.42,-9.17,;10.86,-7.89,;10.86,-9.74,;9.25,-10.44,;9.46,-11.94,;15.04,-9.45,;15.81,-8.1,;17.34,-8.1,;18.14,-9.45,;17.37,-10.78,;15.81,-10.78,;19.68,-9.43,;20.44,-8.1,;21.97,-8.1,;22.75,-9.43,;21.98,-10.78,;20.44,-10.78,)|
Structure
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