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Target
Squalene synthase
Ligand
BDBM50038123
Substrate
n/a
Meas. Tech.
ChEMBL_202115 (CHEMBL808973)
IC50
0.14±n/a nM
Citation
 Ponpipom, MM; Girotra, NN; Bugianesi, RL; Roberts, CD; Berger, GD; Burk, RM; Marquis, RW; Parsons, WH; Bartizal, KF; Bergstom, JD Structure-activity relationships of C1 and C6 side chains of zaragozic acid A derivatives. J Med Chem 37:4031-51 (1994) [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:
BDBM50038123
Synonyms:
(6R,7R)-4,7-Dihydroxy-1-(5-methyl-6-phenyl-hexyl)-6-((E)-6-methyl-9-phenyl-non-4-enoyloxy)-2,8-dioxa-bicyclo[3.2.1]octane-3,4,5-tricarboxylic acid | CHEMBL131201
Type:
Small organic molecule
Emp. Form.:
C38H48O12
Mol. Mass.:
696.7805
SMILES:
CC(CCCCC12OC([C@H](OC(=O)CC\C=C\C(C)CCCc3ccccc3)[C@H]1O)(C(O)=O)C(O)(C(O2)C(O)=O)C(O)=O)Cc1ccccc1
Structure:
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