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Target
Squalene synthase
Ligand
BDBM50076045
Substrate
n/a
Meas. Tech.
ChEBML_70751
IC50
5000±n/a nM
Citation
 Liu, R; Dong, DL; Sherlock, R; Nestler, HP; Gennari, C; Mielgo, A; Scolastico, C Novel reverse-turn mimics inhibit farnesyl transferase. Bioorg Med Chem Lett 9:847-52 (1999) [PubMed]  Article 
Target
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:
MEFVKCLGHPEEFYNLVRFRIGGKRKVMPKMDQDSLSSSLKTCYKYLNQTSRSFAAVIQALDGEMRNAVCIFYLVLRALDTLEDDMTISVEKKVPLLHNFHSFLYQPDWRFMESKEKDRQVLEDFPTISLEFRNLAEKYQTVIADICRRMGIGMAEFLDKHVTSEQEWDKYCHYVAGLVGIGLSRLFSASEFEDPLVGEDTERANSMGLFLQKTNIIRDYLEDQQGGREFWPQEVWSRYVKKLGDFAKPENIDLAVQCLNELITNALHHIPDVITYLSRLRNQSVFNFCAIPQVMAIATLAACYNNQQVFKGAVKIRKGQAVTLMMDATNMPAVKAIIYQYMEEIYHRIPDSDPSSSKTRQIISTIRTQNLPNCQLISRSHYSPIYLSFVMLLAALSWQYLTTLSQVTEDYVQTGEH
  
Inhibitor
Name:
BDBM50076045
Synonyms:
(S)-2-({(3S,6R,8aR)-6-Benzyl-6-[(R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-mercapto-propionylamino]-5-oxo-octahydro-indolizine-3-carbonyl}-amino)-4-methylsulfanyl-butyric acid | CHEMBL434494
Type:
Small organic molecule
Emp. Form.:
C39H44N4O7S2
Mol. Mass.:
744.919
SMILES:
CSCC[C@H](NC(=O)[C@@H]1CC[C@@H]2CC[C@](Cc3ccccc3)(NC(=O)[C@H](CS)NC(=O)OCC3c4ccccc4-c4ccccc34)C(=O)N12)C(O)=O
Structure:
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