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Assay Detail

CHEMBL659315

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

Binding
Inhibition of Caspase-1 enzyme
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Caspase-1 (CHEMBL4801)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Acyl dipeptides as reversible caspase inhibitors. Part 2: further optimization.
Linton SD, Karanewsky DS, Ternansky RJ, Chen N, Guo X, Jahangiri KG, Kalish VJ, Meduna SP, Robinson ED, Ullman BR, Wu JC, Pham B, Kodandapani L, Smidt R, Diaz JL, Fritz LC, von Krosigk U, Roggo S, Schmitz A, Tomaselli KJ.
Bioorg Med Chem Lett (2002) 12 : 2973 -2975
PubMed 12270186 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 6.37 7.82

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL323322 1 7.82
CHEMBL322631 1 7.48
CHEMBL3142757 1 7.06
CHEMBL100559 1 6.90
CHEMBL317246 1 6.60
CHEMBL101182 1 6.48
CHEMBL323570 1 6.47
CHEMBL101145 1 6.42
CHEMBL101622 1 6.10
CHEMBL328155 1 5.72
CHEMBL100591 1 5.66
CHEMBL100643 1 5.59
CHEMBL327298 1 5.53
CHEMBL101545 1 5.31

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL323322 IC50 = 15.0 nM 7.82
CHEMBL322631 IC50 = 33.0 nM 7.48
CHEMBL3142757 IC50 = 87.0 nM 7.06
CHEMBL100559 IC50 = 127.0 nM 6.90
CHEMBL317246 IC50 = 250.0 nM 6.60
CHEMBL101182 IC50 = 330.0 nM 6.48
CHEMBL323570 IC50 = 336.0 nM 6.47
CHEMBL101145 IC50 = 385.0 nM 6.42
CHEMBL101622 IC50 = 790.0 nM 6.10
CHEMBL328155 IC50 = 1890.0 nM 5.72
CHEMBL100591 IC50 = 2180.0 nM 5.66
CHEMBL100643 IC50 = 2550.0 nM 5.59
CHEMBL327298 IC50 = 2960.0 nM 5.53
CHEMBL101545 IC50 = 4860.0 nM 5.31