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Assay Detail

CHEMBL658623

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Binding
Inhibitory concentration required against human Caspase-3
26
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Caspase-3 (CHEMBL2334)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Nicotinyl aspartyl ketones as inhibitors of caspase-3.
Isabel E, Black WC, Bayly CI, Grimm EL, Janes MK, McKay DJ, Nicholson DW, Rasper DM, Renaud J, Roy S, Tam J, Thornberry NA, Vaillancourt JP, Xanthoudakis S, Zamboni R.
Bioorg Med Chem Lett (2003) 13 : 2137 -2140
PubMed 12798321 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 26 5.91 7.57

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL417149 1 7.57
CHEMBL308465 1 6.89
CHEMBL68251 1 6.89
CHEMBL303864 1 6.77
CHEMBL66937 1 6.77
CHEMBL432331 1 6.60
CHEMBL303405 1 6.57
CHEMBL65959 1 6.52
CHEMBL420366 1 6.47
CHEMBL302972 1 6.41
CHEMBL66048 1 6.40
CHEMBL66690 1 6.39
CHEMBL68379 1 6.28
CHEMBL65994 1 6.21
CHEMBL421678 1 5.97
CHEMBL422409 1 5.96
CHEMBL306452 1 5.92
CHEMBL67955 1 5.22
CHEMBL67398 1 5.00
CHEMBL70071 1 4.93
CHEMBL306915 1 4.86
CHEMBL67186 1 4.64
CHEMBL304276 1 4.26
CHEMBL67349 1 4.20
CHEMBL69426 1 4.01
CHEMBL67956 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL417149 IC50 = 27.0 nM 7.57
CHEMBL308465 IC50 = 130.0 nM 6.89
CHEMBL68251 IC50 = 130.0 nM 6.89
CHEMBL303864 IC50 = 170.0 nM 6.77
CHEMBL66937 IC50 = 170.0 nM 6.77
CHEMBL432331 IC50 = 250.0 nM 6.60
CHEMBL303405 IC50 = 270.0 nM 6.57
CHEMBL65959 IC50 = 300.0 nM 6.52
CHEMBL420366 IC50 = 340.0 nM 6.47
CHEMBL302972 IC50 = 390.0 nM 6.41
CHEMBL66048 IC50 = 400.0 nM 6.40
CHEMBL66690 IC50 = 410.0 nM 6.39
CHEMBL68379 IC50 = 520.0 nM 6.28
CHEMBL65994 IC50 = 620.0 nM 6.21
CHEMBL421678 IC50 = 1070.0 nM 5.97
CHEMBL422409 IC50 = 1100.0 nM 5.96
CHEMBL306452 IC50 = 1200.0 nM 5.92
CHEMBL67955 IC50 = 6000.0 nM 5.22
CHEMBL67398 IC50 = 10000.0 nM 5.00
CHEMBL70071 IC50 = 11700.0 nM 4.93
CHEMBL306915 IC50 = 13700.0 nM 4.86
CHEMBL67186 IC50 = 23000.0 nM 4.64
CHEMBL304276 IC50 = 55000.0 nM 4.26
CHEMBL67349 IC50 = 63700.0 nM 4.20
CHEMBL69426 IC50 = 96900.0 nM 4.01
CHEMBL67956 IC50 > 200000.0 nM -