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Assay Detail

CHEMBL4428693

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

Binding
Inhibition of human adenosine kinase assessed as effect on reduced nicotinamide-adenine dinculeotide appearance using inosine as substrate in presence of NAD, ATP incubated for 4 hrs by IMPDH based coupled enzymatic assay based non-isotopic method
14
Total Activities
14
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

Adenosine kinase (CHEMBL3589)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

South (S)- and North (N)-Methanocarba-7-Deazaadenosine Analogues as Inhibitors of Human Adenosine Kinase.
Toti KS, Osborne D, Ciancetta A, Boison D, Jacobson KA.
J Med Chem (2016) 59 : 6860 -6877
PubMed 27410258 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 6.34 7.32

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4460859 1 7.32
CHEMBL4578381 1 7.06
CHEMBL4570382 1 6.96
CHEMBL4560021 1 6.94
CHEMBL4439949 1 6.94
CHEMBL4552895 1 6.85
CHEMBL99203 IODOTUBERCIDIN 1 6.09
CHEMBL4571377 1 5.65
CHEMBL4472686 1 5.48
CHEMBL4525611 1 5.27
CHEMBL4519937 1 5.22
CHEMBL4458520 1 -
CHEMBL4539530 1 -
CHEMBL4518728 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4460859 IC50 = 48.0 nM 7.32
CHEMBL4578381 IC50 = 88.0 nM 7.06
CHEMBL4570382 IC50 = 110.0 nM 6.96
CHEMBL4560021 IC50 = 115.0 nM 6.94
CHEMBL4439949 IC50 = 114.0 nM 6.94
CHEMBL4552895 IC50 = 140.0 nM 6.85
CHEMBL99203 IODOTUBERCIDIN IC50 = 820.0 nM 6.09
CHEMBL4571377 IC50 = 2240.0 nM 5.65
CHEMBL4472686 IC50 = 3340.0 nM 5.48
CHEMBL4525611 IC50 = 5380.0 nM 5.27
CHEMBL4519937 IC50 = 6010.0 nM 5.22
CHEMBL4458520 IC50 - -
CHEMBL4539530 IC50 - -
CHEMBL4518728 IC50 - -