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Target
Squalene synthase
Ligand
BDBM50052362
Substrate
n/a
Meas. Tech.
ChEMBL_202113 (CHEMBL808971)
IC50
60±n/a nM
Citation
 Brown, GR; Clarke, DS; Foubister, AJ; Freeman, S; Harrison, PJ; Johnson, MC; Mallion, KB; McCormick, J; McTaggart, F; Reid, AC; Smith, GJ; Taylor, MJ Synthesis and activity of a novel series of 3-biarylquinuclidine squalene synthase inhibitors. J Med Chem 39:2971-9 (1996) [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:
BDBM50052362
Synonyms:
3-(2-Phenyl-thiazol-5-yl)-1-aza-bicyclo[2.2.2]octan-3-ol | CHEMBL319389
Type:
Small organic molecule
Emp. Form.:
C16H18N2OS
Mol. Mass.:
286.392
SMILES:
OC1(CN2CCC1CC2)c1cnc(s1)-c1ccccc1 |THB:9:1:7.8:5.4,0:1:7.8:5.4,(13.95,-7.3,;13.57,-9.29,;13.88,-10.79,;12.38,-10.11,;10.74,-10.82,;10.53,-9.33,;12.11,-8.63,;12.11,-6.79,;12.66,-8.06,;15.12,-9.31,;16.03,-8.06,;17.48,-8.53,;17.48,-10.09,;16.02,-10.57,;18.71,-10.99,;20.12,-10.37,;21.35,-11.27,;21.2,-12.8,;19.79,-13.43,;18.56,-12.52,)|
Structure:
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