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Assay Detail

CHEMBL909966

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Binding
Inhibition of caspase 3
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

5-pyrrolidinylsulfonyl isatins as a potential tool for the molecular imaging of caspases in apoptosis.
Kopka K, Faust A, Keul P, Wagner S, Breyholz HJ, Höltke C, Schober O, Schäfers M, Levkau B.
J Med Chem (2006) 49 : 6704 -6715
PubMed 17154501 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 20 7.93 9.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL213759 1 9.52
CHEMBL216071 1 8.77
CHEMBL216819 1 8.62
CHEMBL384023 1 8.62
CHEMBL387041 1 8.42
CHEMBL200927 1 8.09
CHEMBL200677 1 8.01
CHEMBL217457 1 7.92
CHEMBL216447 1 7.79
CHEMBL62993 1 7.77
CHEMBL386510 1 7.76
CHEMBL217777 1 7.74
CHEMBL217821 1 7.70
CHEMBL217822 (S)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin 1 7.59
CHEMBL385930 1 7.59
CHEMBL215480 1 7.44
CHEMBL217220 1 7.32
CHEMBL60190 1 7.07
CHEMBL293034 1 6.94
CHEMBL386464 (S)-5-[1-(2-phenoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL213759 IC50 = 0.3 nM 9.52
CHEMBL216071 IC50 = 1.7 nM 8.77
CHEMBL216819 IC50 = 2.4 nM 8.62
CHEMBL384023 IC50 = 2.4 nM 8.62
CHEMBL387041 IC50 = 3.8 nM 8.42
CHEMBL200927 IC50 = 8.2 nM 8.09
CHEMBL200677 IC50 = 9.7 nM 8.01
CHEMBL217457 IC50 = 12.0 nM 7.92
CHEMBL216447 IC50 = 16.3 nM 7.79
CHEMBL62993 IC50 = 16.9 nM 7.77
CHEMBL386510 IC50 = 17.5 nM 7.76
CHEMBL217777 IC50 = 18.4 nM 7.74
CHEMBL217821 IC50 = 20.0 nM 7.70
CHEMBL217822 (S)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin IC50 = 25.5 nM 7.59
CHEMBL385930 IC50 = 25.6 nM 7.59
CHEMBL215480 IC50 = 36.4 nM 7.44
CHEMBL217220 IC50 = 47.8 nM 7.32
CHEMBL60190 IC50 = 84.9 nM 7.07
CHEMBL293034 IC50 = 114.0 nM 6.94
CHEMBL386464 (S)-5-[1-(2-phenoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin IC50 > 10000.0 nM -