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Target
Sulfotransferase 1E1
Ligand
BDBM50102702
Substrate
n/a
Meas. Tech.
ChEMBL_67847 (CHEMBL681339)
IC50
30000±n/a nM
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 Chem 44:2683-6 (2001) [PubMed]
Target
Name:
Sulfotransferase 1E1
Synonyms:
Est | Estrogen sulfotransferase | ST1E1_MOUSE | Ste | Sult1e1
Type:
PROTEIN
Mol. Mass.:
35591.32
Organism:
Mus musculus
Description:
ChEMBL_67847
Residue:
295
Sequence:
METSMPEYYEVFGEFRGVLMDKRFTKYWEDVEMFLARPDDLVIATYPKSGTTWISEVVYMIYKEGDVEKCKEDAIFNRIPYLECRNEDLINGIKQLKEKESPRIVKTHLPPKLLPASFWEKNCKMIYLCRNAKDVAVSYYYFLLMITSYPNPKSFSEFVEKFMQGQVPYGSWYDHVKAWWEKSKNSRVLFMFYEDMKEDIRREVVKLIEFLERKPSAELVDRIIQHTSFQEMKNNPSTNYTMMPEEMMNQKVSPFMRKGIIGDWKNHFPEALRERFDEHYKQQMKDCTVKFRMEL
  
Inhibitor
Name:
BDBM50102702
Synonyms:
2-[2-Benzylamino-6-(4-methoxy-benzylamino)-purin-9-yl]-ethanol(NG17) | CHEMBL91816
Type:
Small organic molecule
Emp. Form.:
C22H24N6O2
Mol. Mass.:
404.465
SMILES:
COc1ccc(CNc2nc(NCc3ccccc3)nc3n(CCO)cnc23)cc1
Structure:
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