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Assay Detail

CHEMBL2072276

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

Binding
Displacement of [125I]I-AB-MECA from human A3 adenosine receptor expressed in CHO cells after 60 mins gamma counter
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type CHO
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Adenosine receptor A3 (CHEMBL256)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Optimization of adenosine 5'-carboxamide derivatives as adenosine receptor agonists using structure-based ligand design and fragment screening.
Tosh DK, Phan K, Gao ZG, Gakh AA, Xu F, Deflorian F, Abagyan R, Stevens RC, Jacobson KA, Katritch V.
J Med Chem (2012) 55 : 4297 -4308
PubMed 22486652 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 9 6.77 7.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL464859 NECA 1 7.80
CHEMBL1235128 1 7.30
CHEMBL2070507 1 7.16
CHEMBL2070508 1 7.16
CHEMBL261482 1 6.75
CHEMBL2070398 1 6.16
CHEMBL1234591 1 5.03
CHEMBL129903 1 -
CHEMBL2070506 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL464859 NECA Ki = 16.0 nM 7.80
CHEMBL1235128 Ki = 50.0 nM 7.30
CHEMBL2070507 Ki = 70.0 nM 7.16
CHEMBL2070508 Ki = 70.0 nM 7.16
CHEMBL261482 Ki = 180.0 nM 6.75
CHEMBL2070398 Ki = 700.0 nM 6.16
CHEMBL1234591 Ki = 9450.0 nM 5.03
CHEMBL129903 Ki = 19600.0 nM -
CHEMBL2070506 Ki > 10000.0 nM -