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Assay Detail

CHEMBL926728

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

Binding
Inhibition of Trypanosoma brucei cathepsin B-like cysteine protease
56
Total Activities
56
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Trypanosoma brucei
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cathepsin B-like cysteine protease (CHEMBL5832)
Type SINGLE PROTEIN
Organism Trypanosoma brucei

Publication

Development of potent purine-derived nitrile inhibitors of the trypanosomal protease TbcatB.
Mallari JP, Shelat AA, Obrien T, Caffrey CR, Kosinski A, Connelly M, Harbut M, Greenbaum D, McKerrow JH, Guy RK.
J Med Chem (2008) 51 : 545 -552
PubMed 18173229 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 56 5.29 6.57

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL254412 1 6.57
CHEMBL252934 1 6.24
CHEMBL400543 1 6.10
CHEMBL400542 1 6.03
CHEMBL254617 1 5.92
CHEMBL400663 1 5.85
CHEMBL399094 1 5.64
CHEMBL254618 1 5.60
CHEMBL252933 1 5.55
CHEMBL400248 1 5.48
CHEMBL251923 1 5.48
CHEMBL254619 1 5.47
CHEMBL255038 1 5.39
CHEMBL255087 1 5.38
CHEMBL255086 1 5.35
CHEMBL398505 1 5.32
CHEMBL252359 1 5.30
CHEMBL400454 1 5.22
CHEMBL400095 1 5.22
CHEMBL252362 1 5.16
CHEMBL399027 1 5.15
CHEMBL252360 1 5.08
CHEMBL254827 1 5.08
CHEMBL402052 1 5.08
CHEMBL253830 1 5.00
CHEMBL255080 1 5.00
CHEMBL399026 1 4.96
CHEMBL429121 1 4.96
CHEMBL252363 1 4.96
CHEMBL400097 1 4.92

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL254412 IC50 = 270.0 nM 6.57
CHEMBL252934 IC50 = 570.0 nM 6.24
CHEMBL400543 IC50 = 800.0 nM 6.10
CHEMBL400542 IC50 = 930.0 nM 6.03
CHEMBL254617 IC50 = 1200.0 nM 5.92
CHEMBL400663 IC50 = 1400.0 nM 5.85
CHEMBL399094 IC50 = 2300.0 nM 5.64
CHEMBL254618 IC50 = 2500.0 nM 5.60
CHEMBL252933 IC50 = 2800.0 nM 5.55
CHEMBL400248 IC50 = 3300.0 nM 5.48
CHEMBL251923 IC50 = 3300.0 nM 5.48
CHEMBL254619 IC50 = 3400.0 nM 5.47
CHEMBL255038 IC50 = 4100.0 nM 5.39
CHEMBL255087 IC50 = 4200.0 nM 5.38
CHEMBL255086 IC50 = 4500.0 nM 5.35
CHEMBL398505 IC50 = 4800.0 nM 5.32
CHEMBL252359 IC50 = 5000.0 nM 5.30
CHEMBL400454 IC50 = 6000.0 nM 5.22
CHEMBL400095 IC50 = 6000.0 nM 5.22
CHEMBL252362 IC50 = 7000.0 nM 5.16
CHEMBL399027 IC50 = 7100.0 nM 5.15
CHEMBL252360 IC50 = 8300.0 nM 5.08
CHEMBL254827 IC50 = 8400.0 nM 5.08
CHEMBL402052 IC50 = 8300.0 nM 5.08
CHEMBL255080 IC50 = 10000.0 nM 5.00
CHEMBL253830 IC50 = 10000.0 nM 5.00
CHEMBL399026 IC50 = 11000.0 nM 4.96
CHEMBL429121 IC50 = 11000.0 nM 4.96
CHEMBL252363 IC50 = 11000.0 nM 4.96
CHEMBL400097 IC50 = 12000.0 nM 4.92
CHEMBL254227 IC50 = 14000.0 nM 4.85
CHEMBL255079 IC50 = 14000.0 nM 4.85
CHEMBL400664 IC50 = 15000.0 nM 4.82
CHEMBL398708 IC50 = 16000.0 nM 4.80
CHEMBL252729 IC50 = 18000.0 nM 4.75
CHEMBL253611 IC50 = 19000.0 nM 4.72
CHEMBL252121 IC50 = 23000.0 nM 4.64
CHEMBL436637 IC50 > 25000.0 nM -
CHEMBL400096 IC50 > 25000.0 nM -
CHEMBL399513 IC50 > 25000.0 nM -
CHEMBL398507 IC50 > 25000.0 nM -
CHEMBL252158 IC50 > 25000.0 nM -
CHEMBL252157 IC50 > 25000.0 nM -
CHEMBL399095 IC50 > 25000.0 nM -
CHEMBL252156 IC50 > 25000.0 nM -
CHEMBL251959 IC50 > 25000.0 nM -
CHEMBL251973 IC50 > 25000.0 nM -
CHEMBL400522 IC50 > 25000.0 nM -
CHEMBL398504 IC50 > 25000.0 nM -
CHEMBL252361 IC50 > 25000.0 nM -