Reaction Details | |||
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Target | Beta-hexosaminidase subunit alpha | ||
Ligand | BDBM50089682 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1496352 (CHEMBL3579956) | ||
IC50 | 43000±n/a nM | ||
Citation | Tropak, MB; Zhang, J; Yonekawa, S; Rigat, BA; Aulakh, VS; Smith, MR; Hwang, HJ; Ciufolini, MA; Mahuran, DJ Pyrimethamine Derivatives: Insight into Binding Mechanism and Improved Enhancement of Mutantß-N-acetylhexosaminidase Activity. J Med Chem58:4483-93 (2015) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Beta-hexosaminidase subunit alpha | |||
Name: | Beta-hexosaminidase subunit alpha | ||
Synonyms: | Beta-N-acetylhexosaminidase subunit alpha | Beta-hexosaminidase subunit alpha (HexA) | HEXA | HEXA_HUMAN | ||
Type: | Protein | ||
Mol. Mass.: | 60688.46 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P06865 | ||
Residue: | 529 | ||
Sequence: |
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BDBM50089682 | |||
n/a | |||
Name | BDBM50089682 | ||
Synonyms: | CHEMBL3577323 | ||
Type | Small organic molecule | ||
Emp. Form. | C13H16N4 | ||
Mol. Mass. | 228.2929 | ||
SMILES | CCc1nc(N)nc(N)c1-c1ccccc1C |(-3.74,-.92,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;,1.54,;,2.77,;1.33,.77,;1.33,-.77,;2.4,-1.39,;,-1.54,;,-3.08,;1.33,-3.85,;1.34,-5.39,;0,-6.16,;-1.33,-5.39,;-1.33,-3.85,;-2.4,-3.24,)| | ||
Structure |