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TargetSqualene synthase
LigandBDBM50338903
Substrate/Competitorn/a
Meas. Tech.ChEMBL_727292 (CHEMBL1687386)
IC50 0.45±n/a nM
Citation Ichikawa, MYokomizo, AItoh, MSugita, KUsui, HShimizu, HSuzuki, MTerayama, KKanda, A Discovery of a new 2-aminobenzhydrol template for highly potent squalene synthase inhibitors. Bioorg Med Chem19:1930-49 (2011) [PubMed]  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
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  Blast E-value cutoff:
BDBM50338903
n/a
NameBDBM50338903
Synonyms:CHEMBL1684849 | Ethyl 1-{4-[{4-chloro-2-[(2-fluorophenyl)(hydroxy)-methyl]phenyl}(2,2-dimethylpropyl)amino]-4-oxobutanoyl}-piperidine-4-carboxylate
TypeSmall organic molecule
Emp. Form.C30H38ClFN2O5
Mol. Mass.561.085
SMILESCCOC(=O)C1CCN(CC1)C(=O)CCC(=O)N(CC(C)(C)C)c1ccc(Cl)cc1C(O)c1ccccc1F
Structure
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