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Assay Detail

CHEMBL2073368

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

Binding
Inhibition of human recombinant cathepsin B using Z-Arg-Arg-AMC as substrate preincubated for 30 mins measured after 1 hr by quenched fluorescent resonance energy transfer assay
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cathepsin B (CHEMBL4072)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Isosteric replacements for benzothiazoles and optimisation to potent Cathepsin K inhibitors free from hERG channel inhibition.
Dossetter AG, Bowyer J, Cook CR, Crawford JJ, Finlayson JE, Heron NM, Heyes C, Highton AJ, Hudson JA, Jestel A, Krapp S, MacFaul PA, McGuire TM, Morley AD, Morris JJ, Page KM, Ribeiro LR, Sawney H, Steinbacher S, Smith C.
Bioorg Med Chem Lett (2012) 22 : 5563 -5568
PubMed 22858142 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 21 5.43 6.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2070936 1 6.00
CHEMBL2070937 1 5.80
CHEMBL2071096 1 5.70
CHEMBL2071098 1 5.60
CHEMBL2070938 1 5.60
CHEMBL2070939 1 5.60
CHEMBL2070940 1 5.50
CHEMBL2070942 1 5.50
CHEMBL2071097 1 5.50
CHEMBL2070951 1 5.50
CHEMBL2069324 1 5.40
CHEMBL2070950 1 5.40
CHEMBL2071095 1 5.40
CHEMBL2070946 1 5.40
CHEMBL2070941 1 5.30
CHEMBL2070948 1 5.30
CHEMBL2070945 1 5.30
CHEMBL2070944 1 5.30
CHEMBL2070943 1 5.20
CHEMBL2070947 1 5.10
CHEMBL2070949 1 4.60

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2070936 IC50 = 1000.0 nM 6.00
CHEMBL2070937 IC50 = 1584.89 nM 5.80
CHEMBL2071096 IC50 = 1995.26 nM 5.70
CHEMBL2071098 IC50 = 2511.89 nM 5.60
CHEMBL2070938 IC50 = 2511.89 nM 5.60
CHEMBL2070939 IC50 = 2511.89 nM 5.60
CHEMBL2070940 IC50 = 3162.28 nM 5.50
CHEMBL2070942 IC50 = 3162.28 nM 5.50
CHEMBL2071097 IC50 = 3162.28 nM 5.50
CHEMBL2070951 IC50 = 3162.28 nM 5.50
CHEMBL2069324 IC50 = 3981.07 nM 5.40
CHEMBL2070950 IC50 = 3981.07 nM 5.40
CHEMBL2071095 IC50 = 3981.07 nM 5.40
CHEMBL2070946 IC50 = 3981.07 nM 5.40
CHEMBL2070941 IC50 = 5011.87 nM 5.30
CHEMBL2070948 IC50 = 5011.87 nM 5.30
CHEMBL2070945 IC50 = 5011.87 nM 5.30
CHEMBL2070944 IC50 = 5011.87 nM 5.30
CHEMBL2070943 IC50 = 6309.57 nM 5.20
CHEMBL2070947 IC50 = 7943.28 nM 5.10
CHEMBL2070949 IC50 = 25118.86 nM 4.60