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Assay Detail

CHEMBL1100258

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

Binding
Inhibition of Trypanosoma cruzi trans-sialidase containing catalytic domain (N58F, R200K) and lectin-like domain (S495 K, V496G, E520K, D593G, I597D, H599R) mutation expressed in Escherichia coli JM109 assessed as MuNANA substrate hydrolysis in presence of 0.1% Triton X-100 by discontinuous fluorimetric assay
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Trypanosoma cruzi
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Potent inhibitor scaffold against Trypanosoma cruzi trans-sialidase.
Arioka S, Sakagami M, Uematsu R, Yamaguchi H, Togame H, Takemoto H, Hinou H, Nishimura S.
Bioorg Med Chem (2010) 18 : 1633 -1640
PubMed 20097567 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 4.62 6.24

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1089732 1 6.24
CHEMBL418068 RHEIN 1 4.85
CHEMBL164 MYRICETIN 1 4.77
CHEMBL151 LUTEOLIN 2.0 1 4.66
CHEMBL247484 TRICETIN 1 4.41
CHEMBL55415 SCUTELLAREIN 1 4.30
CHEMBL50 QUERCETIN 3.0 1 4.24
CHEMBL28 APIGENIN 1 4.11
CHEMBL8260 BAICALEIN 2.0 1 4.00
CHEMBL150 KAEMPFEROL 1.0 1 -
CHEMBL289277 EMODIN 1 -
CHEMBL210635 GENKWANIN 1 -
CHEMBL44 GENISTEIN 2.0 1 -
CHEMBL117 CHRYSIN 1 -
CHEMBL242385 1 -
CHEMBL455581 1 -
CHEMBL53418 DANTHRON 4.0 1 -
CHEMBL484662 1 -
CHEMBL294878 1 -
CHEMBL200715 (-)-CATECHIN 1 -
CHEMBL16807 5-HYDROXYFLAVONE 1 -
CHEMBL243664 ACACETIN 1 -
CHEMBL448297 SAKURANETIN 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1089732 IC50 = 580.0 nM 6.24
CHEMBL418068 RHEIN IC50 = 14000.0 nM 4.85
CHEMBL164 MYRICETIN IC50 = 17000.0 nM 4.77
CHEMBL151 LUTEOLIN IC50 = 22000.0 nM 4.66
CHEMBL247484 TRICETIN IC50 = 39000.0 nM 4.41
CHEMBL55415 SCUTELLAREIN IC50 = 50000.0 nM 4.30
CHEMBL50 QUERCETIN IC50 = 58000.0 nM 4.24
CHEMBL28 APIGENIN IC50 = 78000.0 nM 4.11
CHEMBL8260 BAICALEIN IC50 = 100000.0 nM 4.00
CHEMBL150 KAEMPFEROL IC50 = 110000.0 nM -
CHEMBL289277 EMODIN IC50 = 110000.0 nM -
CHEMBL210635 GENKWANIN IC50 = 140000.0 nM -
CHEMBL44 GENISTEIN IC50 = 230000.0 nM -
CHEMBL117 CHRYSIN IC50 = 340000.0 nM -
CHEMBL242385 IC50 = 360000.0 nM -
CHEMBL455581 IC50 = 430000.0 nM -
CHEMBL53418 DANTHRON IC50 = 710000.0 nM -
CHEMBL484662 IC50 > 1000000.0 nM -
CHEMBL294878 IC50 > 1000000.0 nM -
CHEMBL200715 (-)-CATECHIN IC50 > 1000000.0 nM -
CHEMBL16807 5-HYDROXYFLAVONE IC50 > 1000000.0 nM -
CHEMBL243664 ACACETIN IC50 > 1000000.0 nM -
CHEMBL448297 SAKURANETIN IC50 > 1000000.0 nM -