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Assay Detail

CHEMBL4012871

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

Binding
Displacement of [3H]CCPA from human adenosine receptor A1 expressed in CHO cell membranes after 3 hrs by microbeta scintillation counting method
43
Total Activities
43
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 receptor A1 (CHEMBL226)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

The 1,2,4-Triazolo[4,3-a]pyrazin-3-one as a Versatile Scaffold for the Design of Potent Adenosine Human Receptor Antagonists. Structural Investigations to Target the A2A Receptor Subtype.
Falsini M, Squarcialupi L, Catarzi D, Varano F, Betti M, Dal Ben D, Marucci G, Buccioni M, Volpini R, De Vita T, Cavalli A, Colotta V.
J Med Chem (2017) 60 : 5772 -5790
PubMed 28590753 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 43 6.98 8.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL487754 1 8.92
CHEMBL464859 NECA 1 8.34
CHEMBL4089735 1 8.09
CHEMBL4066559 1 8.05
CHEMBL4080925 1 7.89
CHEMBL4068548 1 7.85
CHEMBL4070286 1 7.75
CHEMBL4088805 1 7.70
CHEMBL4097391 1 7.36
CHEMBL4081800 1 7.35
CHEMBL4059885 1 7.35
CHEMBL4094093 1 7.33
CHEMBL4105169 1 7.17
CHEMBL4082584 1 6.89
CHEMBL4090423 1 6.61
CHEMBL4061617 1 6.61
CHEMBL4082891 1 6.21
CHEMBL4059695 1 6.16
CHEMBL4097464 1 6.00
CHEMBL4062442 1 5.83
CHEMBL4067571 1 5.76
CHEMBL4072104 1 5.67
CHEMBL4086268 1 5.43
CHEMBL4100596 1 5.24
CHEMBL4079325 1 -
CHEMBL4069525 1 -
CHEMBL4098254 1 -
CHEMBL4080233 1 -
CHEMBL4081637 1 -
CHEMBL4098141 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL487754 Ki = 1.2 nM 8.92
CHEMBL464859 NECA Ki = 4.6 nM 8.34
CHEMBL4089735 Ki = 8.1 nM 8.09
CHEMBL4066559 Ki = 8.9 nM 8.05
CHEMBL4080925 Ki = 13.0 nM 7.89
CHEMBL4068548 Ki = 14.0 nM 7.85
CHEMBL4070286 Ki = 18.0 nM 7.75
CHEMBL4088805 Ki = 20.0 nM 7.70
CHEMBL4097391 Ki = 44.0 nM 7.36
CHEMBL4081800 Ki = 45.0 nM 7.35
CHEMBL4059885 Ki = 45.0 nM 7.35
CHEMBL4094093 Ki = 47.0 nM 7.33
CHEMBL4105169 Ki = 67.0 nM 7.17
CHEMBL4082584 Ki = 129.0 nM 6.89
CHEMBL4061617 Ki = 247.0 nM 6.61
CHEMBL4090423 Ki = 247.0 nM 6.61
CHEMBL4082891 Ki = 616.0 nM 6.21
CHEMBL4059695 Ki = 698.0 nM 6.16
CHEMBL4097464 Ki = 1000.0 nM 6.00
CHEMBL4062442 Ki = 1480.0 nM 5.83
CHEMBL4067571 Ki = 1743.0 nM 5.76
CHEMBL4072104 Ki = 2142.0 nM 5.67
CHEMBL4086268 Ki = 3704.0 nM 5.43
CHEMBL4100596 Ki = 5740.0 nM 5.24
CHEMBL4064795 Ki > 30000.0 nM -
CHEMBL4098310 Ki > 30000.0 nM -
CHEMBL4071262 Ki > 30000.0 nM -
CHEMBL4092862 Ki - -
CHEMBL4090541 Ki > 30000.0 nM -
CHEMBL4089671 Ki > 30000.0 nM -
CHEMBL4079360 Ki > 30000.0 nM -
CHEMBL4103595 Ki > 30000.0 nM -
CHEMBL4095840 Ki - -
CHEMBL4068501 Ki > 30000.0 nM -
CHEMBL4071082 Ki > 30000.0 nM -
CHEMBL4088110 Ki > 30000.0 nM -
CHEMBL4059837 Ki - -
CHEMBL4098141 Ki > 30000.0 nM -
CHEMBL4081637 Ki > 30000.0 nM -
CHEMBL4080233 Ki > 30000.0 nM -
CHEMBL4098254 Ki > 30000.0 nM -
CHEMBL4069525 Ki > 30000.0 nM -
CHEMBL4079325 Ki > 30000.0 nM -