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Assay Detail

CHEMBL657288

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

Binding
Inhibitory activity against recombinant human cathepsin B (cat B) expressed in baculovirus.
35
Total Activities
33
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Cathepsin B (CHEMBL4072)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of dipeptidyl nitriles as potent and selective inhibitors of cathepsin B through structure-based drug design.
Greenspan PD, Clark KL, Tommasi RA, Cowen SD, McQuire LW, Farley DL, van Duzer JH, Goldberg RL, Zhou H, Du Z, Fitt JJ, Coppa DE, Fang Z, Macchia W, Zhu L, Capparelli MP, Goldstein R, Wigg AM, Doughty JR, Bohacek RS, Knap AK.
J Med Chem (2001) 44 : 4524 -4534
PubMed 11741472 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 35 7.09 8.74

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL336228 2 8.74
CHEMBL138499 1 8.70
CHEMBL344035 1 8.25
CHEMBL134083 1 8.17
CHEMBL337090 1 8.03
CHEMBL336436 1 7.99
CHEMBL138661 1 7.92
CHEMBL140506 1 7.77
CHEMBL343759 1 7.75
CHEMBL343423 1 7.54
CHEMBL336458 1 7.51
CHEMBL336474 1 7.50
CHEMBL141793 1 7.45
CHEMBL140606 1 7.38
CHEMBL140756 2 7.35
CHEMBL342463 1 7.33
CHEMBL142118 1 7.14
CHEMBL342437 1 6.96
CHEMBL139132 1 6.92
CHEMBL343957 1 6.89
CHEMBL423923 1 6.87
CHEMBL140429 1 6.86
CHEMBL436604 1 6.51
CHEMBL138611 1 6.45
CHEMBL342145 1 6.30
CHEMBL140824 1 6.23
CHEMBL345081 1 6.19
CHEMBL138586 1 5.72
CHEMBL440347 1 5.52
CHEMBL140794 1 4.47

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL336228 IC50 = 1.8 nM 8.74
CHEMBL138499 IC50 = 2.0 nM 8.70
CHEMBL336228 IC50 = 5.0 nM 8.30
CHEMBL344035 IC50 = 5.6 nM 8.25
CHEMBL134083 IC50 = 6.8 nM 8.17
CHEMBL337090 IC50 = 9.4 nM 8.03
CHEMBL336436 IC50 = 10.2 nM 7.99
CHEMBL138661 IC50 = 11.9 nM 7.92
CHEMBL140506 IC50 = 16.9 nM 7.77
CHEMBL343759 IC50 = 18.0 nM 7.75
CHEMBL343423 IC50 = 29.0 nM 7.54
CHEMBL336458 IC50 = 30.7 nM 7.51
CHEMBL336474 IC50 = 31.3 nM 7.50
CHEMBL141793 IC50 = 35.7 nM 7.45
CHEMBL140606 IC50 = 42.0 nM 7.38
CHEMBL140756 IC50 = 45.0 nM 7.35
CHEMBL342463 IC50 = 47.0 nM 7.33
CHEMBL142118 IC50 = 72.0 nM 7.14
CHEMBL140756 IC50 = 87.0 nM 7.06
CHEMBL342437 IC50 = 110.0 nM 6.96
CHEMBL139132 IC50 = 121.0 nM 6.92
CHEMBL343957 IC50 = 130.0 nM 6.89
CHEMBL423923 IC50 = 136.0 nM 6.87
CHEMBL140429 IC50 = 138.0 nM 6.86
CHEMBL436604 IC50 = 308.0 nM 6.51
CHEMBL138611 IC50 = 358.0 nM 6.45
CHEMBL342145 IC50 = 496.0 nM 6.30
CHEMBL140824 IC50 = 591.0 nM 6.23
CHEMBL345081 IC50 = 652.0 nM 6.19
CHEMBL138586 IC50 = 1900.0 nM 5.72
CHEMBL440347 IC50 = 3000.0 nM 5.52
CHEMBL140794 IC50 = 34000.0 nM 4.47
CHEMBL344174 IC50 = 62000.0 nM 4.21
CHEMBL138284 IC50 > 1000.0 nM -
CHEMBL337111 IC50 > 1000.0 nM -