Target
Squalene synthase
Ligand
BDBM50388384
Substrate
n/a
Meas. Tech.
ChEMBL_829805 (CHEMBL2061324)
IC50
0.89±n/a nM
Citation
 Ichikawa, MOhtsuka, MOhki, HHaginoya, NItoh, MSugita, KUsui, HSuzuki, MTerayama, KKanda, A Discovery of novel tricyclic compounds as squalene synthase inhibitors. Bioorg Med Chem 20:3072-93 (2012) [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:
BDBM50388384
Synonyms:
CHEMBL2057958
Type:
Small organic molecule
Emp. Form.:
C24H22ClN5O5
Mol. Mass.:
495.915
SMILES:
COc1cccc([C@H]2O[C@H](CCn3nnc(n3)C(O)=O)c3cccn3-c3ccc(Cl)cc23)c1OC |r|
Structure:
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