| Reaction Details |
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 | Report a problem with these data |
| Target | Squalene synthase |
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| Ligand | BDBM50281079 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_202106 |
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| IC50 | 355±n/a nM |
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| Citation |  Watson, NS; Bell, R; Chan, C; Cox, B; Hutson, JL; Keeling, SE; Kirk, BE; Procopiou, PA; Steeples, IP; Widdowson, J The squalestatins: potent inhibitors of squalene synthase. The role of the tricarboxylic acid moiety. Bioorg Med Chem Lett3:2541-2546 (1993) 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 |
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| Synonyms: | FDFT_RAT | FPP:FPP farnesyltransferase | Farnesyl-diphosphate farnesyltransferase | Fdft1 | SQS | SS | Squalene synthetase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 48109.41 |
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| Organism: | Rattus norvegicus |
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| Description: | ChEMBL_1336736 |
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| Residue: | 416 |
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| Sequence: | MEFVKCLGHPEEFYNLLRFRMGGRRNFIPKMDRNSLSNSLKTCYKYLDQTSRSFAAVIQA
LDGDIRHAVCVFYLILRAMDTVEDDMAISVEKKIPLLRNFHTFLYEPEWRFTESKEKHRV
VLEDFPTISLEFRNLAEKYQTVIADICHRMGCGMAEFLNKDVTSKQDWDKYCHYVAGLVG
IGLSRLFSASEFEDPIVGEDTECANSMGLFLQKTNIIRDYLEDQQEGRQFWPQEVWGKYV
KKLEDFVKPENVDVAVKCLNELITNALQHIPDVITYLSRLRNQSVFNFCAIPQVMAIATL
AACYNNHQVFKGVVKIRKGQAVTLMMDATNMPAVKAIIYQYIEEIYHRVPNSDPSASKAK
QLISNIRTQSLPNCQLISRSHYSPIYLSFIMLLAALSWQYLSTLSQVTEDYVQREH
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| BDBM50281079 |
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| n/a |
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| Name | BDBM50281079 |
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| Synonyms: | (1S,3S,4S,5R,6R,7R)-1-((4S,5R)-4-Acetoxy-5-methyl-3-methylene-6-phenyl-hexyl)-4,6,7-trihydroxy-2,8-dioxa-bicyclo[3.2.1]octane-3,4,5-tricarboxylic acid 4-methyl ester | CHEMBL310898 |
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| Type | Small organic molecule |
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| Emp. Form. | C26H32O13 |
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| Mol. Mass. | 552.5245 |
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| SMILES | COC(=O)[C@]1(O)[C@H](O[C@@]2(CCC(=C)[C@@H](OC(C)=O)[C@H](C)Cc3ccccc3)O[C@@]1([C@H](O)[C@H]2O)C(O)=O)C(O)=O |
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| Structure | 
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