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Assay Detail

CHEMBL3579956

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human placental HexA using pNPGlcNAc substrate
17
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 5 — Multiple protein complex / RNA
Curated By Autocuration

Target

Beta-N-acetyl-D-hexosaminidase-A/B (CHEMBL3038485)
Type PROTEIN FAMILY
Organism Homo sapiens

Publication

Pyrimethamine Derivatives: Insight into Binding Mechanism and Improved Enhancement of Mutant β-N-acetylhexosaminidase Activity.
Tropak MB, Zhang J, Yonekawa S, Rigat BA, Aulakh VS, Smith MR, Hwang HJ, Ciufolini MA, Mahuran DJ.
J Med Chem (2015) 58 : 4483 -4493
PubMed 25984755 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 4.57 4.82

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3577321 1 4.82
CHEMBL36 PYRIMETHAMINE 4.0 1 4.77
CHEMBL3577317 1 4.75
CHEMBL281412 1 4.75
CHEMBL22148 1 4.50
CHEMBL3577322 1 4.47
CHEMBL21778 1 4.40
CHEMBL3577323 1 4.37
CHEMBL3577324 1 4.33
CHEMBL3577319 1 -
CHEMBL3577320 1 -
CHEMBL3577318 1 -
CHEMBL21357 1 -
CHEMBL3577316 1 -
CHEMBL3577315 1 -
CHEMBL3577314 1 -
CHEMBL3577313 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3577321 IC50 = 15000.0 nM 4.82
CHEMBL36 PYRIMETHAMINE IC50 = 17000.0 nM 4.77
CHEMBL3577317 IC50 = 18000.0 nM 4.75
CHEMBL281412 IC50 = 18000.0 nM 4.75
CHEMBL22148 IC50 = 32000.0 nM 4.50
CHEMBL3577322 IC50 = 34000.0 nM 4.47
CHEMBL21778 IC50 = 40000.0 nM 4.40
CHEMBL3577323 IC50 = 43000.0 nM 4.37
CHEMBL3577324 IC50 = 47000.0 nM 4.33
CHEMBL3577319 IC50 > 1400000.0 nM -
CHEMBL3577320 IC50 = 180000.0 nM -
CHEMBL3577318 IC50 > 410000.0 nM -
CHEMBL21357 IC50 > 560000.0 nM -
CHEMBL3577316 IC50 > 940000.0 nM -
CHEMBL3577315 IC50 > 400000.0 nM -
CHEMBL3577314 IC50 > 400000.0 nM -
CHEMBL3577313 IC50 > 2100000.0 nM -