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Assay Detail

CHEMBL1679625

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Binding
Inhibition of human recombinant cathepsin S after 1 hr
17
Total Activities
17
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 S (CHEMBL2954)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of novel cyanamide-based inhibitors of cathepsin C.
Lainé D, Palovich M, McCleland B, Petitjean E, Delhom I, Xie H, Deng J, Lin G, Davis R, Jolit A, Nevins N, Zhao B, Villa J, Schneck J, McDevitt P, Midgett R, Kmett C, Umbrecht S, Peck B, Davis AB, Bettoun D.
ACS Med Chem Lett (2011) 2 : 142 -147
PubMed 24900293 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 5.57 6.90

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1672427 1 6.90
CHEMBL1672425 1 6.50
CHEMBL1672421 1 6.30
CHEMBL1672434 1 6.00
CHEMBL1672422 1 5.80
CHEMBL1672419 1 5.80
CHEMBL1672426 1 5.70
CHEMBL1672432 1 5.40
CHEMBL1672424 1 5.40
CHEMBL1672420 1 5.10
CHEMBL1672423 1 4.90
CHEMBL1672430 1 4.80
CHEMBL1672433 1 4.80
CHEMBL262697 CYANO-PYRROLIDINE 1 4.60
CHEMBL1672428 1 -
CHEMBL1672429 1 -
CHEMBL1672431 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1672427 IC50 = 125.89 nM 6.90
CHEMBL1672425 IC50 = 316.23 nM 6.50
CHEMBL1672421 IC50 = 501.19 nM 6.30
CHEMBL1672434 IC50 = 1000.0 nM 6.00
CHEMBL1672422 IC50 = 1584.89 nM 5.80
CHEMBL1672419 IC50 = 1584.89 nM 5.80
CHEMBL1672426 IC50 = 1995.26 nM 5.70
CHEMBL1672432 IC50 = 3981.07 nM 5.40
CHEMBL1672424 IC50 = 3981.07 nM 5.40
CHEMBL1672420 IC50 = 7943.28 nM 5.10
CHEMBL1672423 IC50 = 12589.25 nM 4.90
CHEMBL1672430 IC50 = 15848.93 nM 4.80
CHEMBL1672433 IC50 = 15848.93 nM 4.80
CHEMBL262697 CYANO-PYRROLIDINE IC50 = 25118.86 nM 4.60
CHEMBL1672428 IC50 > 25118.86 nM -
CHEMBL1672429 IC50 > 25118.86 nM -
CHEMBL1672431 IC50 > 25118.86 nM -