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Assay Detail

CHEMBL750866

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

Binding
In vitro inhibitory concentration against dog kidney Na+,K+-ATPase
11
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Canis lupus familiaris
Confidence 9 — Direct single protein target
Curated By Expert

Target

Sodium/potassium-transporting ATPase subunit alpha-1 (CHEMBL4838)
Type SINGLE PROTEIN
Organism Canis lupus familiaris

Publication

17beta-O-Aminoalkyloximes of 5beta-androstane-3beta,14beta-diol with digitalis-like activity: synthesis, cardiotonic activity, structure-activity relationships, and molecular modeling of the Na(+),K(+)-ATPase receptor.
Cerri A, Almirante N, Barassi P, Benicchio A, Fedrizzi G, Ferrari P, Micheletti R, Quadri L, Ragg E, Rossi R, Santagostino M, Schiavone A, Serra F, Zappavigna MP, Melloni P.
J Med Chem (2000) 43 : 2332 -2349
PubMed 10882359 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 11 5.56 6.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2068890 1 6.60
CHEMBL2068972 1 6.50
CHEMBL1751 DIGOXIN 4.0 1 6.30
CHEMBL1453 DIGITOXIGENIN 1 6.30
CHEMBL2068902 1 5.90
CHEMBL2068975 1 5.80
CHEMBL2069058 1 5.20
CHEMBL2068981 1 4.60
CHEMBL2068977 1 4.40
CHEMBL2068976 1 4.00
CHEMBL2068898 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2068890 IC50 = 250.0 nM 6.60
CHEMBL2068972 IC50 = 320.0 nM 6.50
CHEMBL1751 DIGOXIN IC50 = 500.0 nM 6.30
CHEMBL1453 DIGITOXIGENIN IC50 = 500.0 nM 6.30
CHEMBL2068902 IC50 = 1250.0 nM 5.90
CHEMBL2068975 IC50 = 1580.0 nM 5.80
CHEMBL2069058 IC50 = 6300.0 nM 5.20
CHEMBL2068981 IC50 = 25000.0 nM 4.60
CHEMBL2068977 IC50 = 40000.0 nM 4.40
CHEMBL2068976 IC50 = 100000.0 nM 4.00
CHEMBL2068898 IC50 > 100000.0 nM -