| Reaction Details |
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 | Report a problem with these data |
| Target | Sulfotransferase 1E1 |
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| Ligand | BDBM50102700 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_67847 (CHEMBL681339) |
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| IC50 | >200000±n/a nM |
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| Citation |  Verdugo, DE; Cancilla, MT; Ge, X; Gray, NS; Chang, YT; Schultz, PG; Negishi, M; Leary, JA; Bertozzi, CR Discovery of estrogen sulfotransferase inhibitors from a purine library screen. J Med Chem44:2683-6 (2001) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| Sulfotransferase 1E1 |
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| Name: | Sulfotransferase 1E1 |
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| Synonyms: | Est | Estrogen sulfotransferase | ST1E1_MOUSE | Ste | Sult1e1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 35591.32 |
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| Organism: | Mus musculus |
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| Description: | ChEMBL_67847 |
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| Residue: | 295 |
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| Sequence: | METSMPEYYEVFGEFRGVLMDKRFTKYWEDVEMFLARPDDLVIATYPKSGTTWISEVVYM
IYKEGDVEKCKEDAIFNRIPYLECRNEDLINGIKQLKEKESPRIVKTHLPPKLLPASFWE
KNCKMIYLCRNAKDVAVSYYYFLLMITSYPNPKSFSEFVEKFMQGQVPYGSWYDHVKAWW
EKSKNSRVLFMFYEDMKEDIRREVVKLIEFLERKPSAELVDRIIQHTSFQEMKNNPSTNY
TMMPEEMMNQKVSPFMRKGIIGDWKNHFPEALRERFDEHYKQQMKDCTVKFRMEL
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| BDBM50102700 |
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| n/a |
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| Name | BDBM50102700 |
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| Synonyms: | 2-[6-(Cyclohexylmethyl-amino)-2-(4-nitro-benzylamino)-purin-9-yl]-ethanol(NG20) | CHEMBL91450 |
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| Type | Small organic molecule |
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| Emp. Form. | C21H27N7O3 |
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| Mol. Mass. | 425.4842 |
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| SMILES | OCCn1cnc2c(NCC3CCCCC3)nc(NCc3ccc(cc3)[N+]([O-])=O)nc12 |
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| Structure | 
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