Reaction Details |
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Target | Squalene synthase |
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Ligand | BDBM50339920 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_740875 (CHEMBL1763976) |
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IC50 | 930±n/a nM |
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Citation | Griebenow, N; Flessner, T; Buchmueller, A; Raabe, M; Bischoff, H; Kolkhof, P Identification and optimization of tetrahydro-2H-3-benzazepin-2-ones as squalene synthase inhibitors. Bioorg Med Chem Lett21:2554-8 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Squalene synthase |
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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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BDBM50339920 |
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n/a |
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Name | BDBM50339920 |
Synonyms: | CHEMBL1761659 | trans-rac-1-(2-(7-chloro-5-(2-chlorophenyl)-1-isobutyl-2-oxo-4,5-dihydro-1H-benzo[d]azepin-3(2H)-yl)acetyl)piperidine-4-carboxylic acid |
Type | Small organic molecule |
Emp. Form. | C28H32Cl2N2O4 |
Mol. Mass. | 531.471 |
SMILES | CC(C)C[C@@H]1c2ccc(Cl)cc2[C@H](CN(CC(=O)N2CCC(CC2)C(O)=O)C1=O)c1ccccc1Cl |r| |
Structure |
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