BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSqualene synthase
LigandBDBM50288819
Substrate/Competitorn/a
Meas. Tech.ChEBML_201961
IC50 2.5±n/a nM
Citation Iwasawa, YShibata, JMitsuya, MMasaki, HHayashi, MKanno, TSawasaki, YHisaka, AKamei, TTomimoto, K J-104,123, a novel and orally-active inhibitor of squalene synthase: Stereoselective synthesis and cholesterol lowering effects in dogs Bioorg Med Chem Lett6:463-466 (1996)    Article
More Info.:Get all data from this article,  Assay Method
 
Squalene synthase
Name:Squalene synthase
Synonyms:FDFT1 | FDFT_HUMAN | FPP:FPP farnesyltransferase | Farnesyl-diphosphate farnesyltransferase | SQS | SS | Squalene synthetase
Type:PROTEIN
Mol. Mass.:48114.76
Organism:Homo sapiens (Human)
Description:ChEMBL_1352847
Residue:417
Sequence:
MEFVKCLGHPEEFYNLVRFRIGGKRKVMPKMDQDSLSSSLKTCYKYLNQTSRSFAAVIQA
LDGEMRNAVCIFYLVLRALDTLEDDMTISVEKKVPLLHNFHSFLYQPDWRFMESKEKDRQ
VLEDFPTISLEFRNLAEKYQTVIADICRRMGIGMAEFLDKHVTSEQEWDKYCHYVAGLVG
IGLSRLFSASEFEDPLVGEDTERANSMGLFLQKTNIIRDYLEDQQGGREFWPQEVWSRYV
KKLGDFAKPENIDLAVQCLNELITNALHHIPDVITYLSRLRNQSVFNFCAIPQVMAIATL
AACYNNQQVFKGAVKIRKGQAVTLMMDATNMPAVKAIIYQYMEEIYHRIPDSDPSSSKTR
QIISTIRTQNLPNCQLISRSHYSPIYLSFVMLLAALSWQYLTTLSQVTEDYVQTGEH
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50288819
n/a
NameBDBM50288819
Synonyms:(R)-4-[(E)-(1S,2S)-2-(3,4-Dichloro-benzyl)-1-methyl-4-naphthalen-2-yl-but-3-enylcarbamoyl]-3-methyl-butyric acid | CHEMBL143820
TypeSmall organic molecule
Emp. Form.C28H29Cl2NO3
Mol. Mass.498.441
SMILESC[C@@H](CC(O)=O)CC(=O)N[C@@H](C)[C@@H](Cc1ccc(Cl)c(Cl)c1)\C=C\c1ccc2ccccc2c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: