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Assay Detail

CHEMBL3863977

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

ADMET
Antagonist activity at adenosine A2a receptor (unknown origin)
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Adenosine receptor A2a (CHEMBL251)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Biphenyl Pyridazinone Derivatives as Inhaled PDE4 Inhibitors: Structural Biology and Structure-Activity Relationships.
Gràcia J, Buil MA, Castro J, Eichhorn P, Ferrer M, Gavaldà A, Hernández B, Segarra V, Lehner MD, Moreno I, Pagès L, Roberts RS, Serrat J, Sevilla S, Taltavull J, Andrés M, Cabedo J, Vilella D, Calama E, Carcasona C, Miralpeix M.
J Med Chem (2016) 59 : 10479 -10497
PubMed 27933955 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 7.24 8.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3918173 1 8.30
CHEMBL3916846 1 8.05
CHEMBL3941513 1 7.66
CHEMBL3980193 1 7.55
CHEMBL3986586 1 7.48
CHEMBL3952586 1 7.48
CHEMBL3968147 1 7.39
CHEMBL3896989 1 7.23
CHEMBL3957127 1 7.07
CHEMBL3905929 1 6.98
CHEMBL3969954 1 6.78
CHEMBL3963331 1 6.57
CHEMBL3903604 1 6.48
CHEMBL3950249 1 6.36
CHEMBL193240 ROFLUMILAST 4.0 1 -
CHEMBL3985784 1 -
CHEMBL3948448 1 -
CHEMBL3977665 1 -
CHEMBL3913876 1 -
CHEMBL3941862 1 -
CHEMBL3945895 1 -
CHEMBL3903408 1 -
CHEMBL3922464 1 -
CHEMBL3919325 1 -
CHEMBL3955694 1 -
CHEMBL3984510 1 -
CHEMBL3892121 1 -
CHEMBL3984674 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3918173 IC50 = 5.0 nM 8.30
CHEMBL3916846 IC50 = 9.0 nM 8.05
CHEMBL3941513 IC50 = 22.0 nM 7.66
CHEMBL3980193 IC50 = 28.0 nM 7.55
CHEMBL3986586 IC50 = 33.0 nM 7.48
CHEMBL3952586 IC50 = 33.0 nM 7.48
CHEMBL3968147 IC50 = 41.0 nM 7.39
CHEMBL3896989 IC50 = 59.0 nM 7.23
CHEMBL3957127 IC50 = 86.0 nM 7.07
CHEMBL3905929 IC50 = 105.0 nM 6.98
CHEMBL3969954 IC50 = 168.0 nM 6.78
CHEMBL3963331 IC50 = 270.0 nM 6.57
CHEMBL3903604 IC50 = 333.0 nM 6.48
CHEMBL3950249 IC50 = 434.0 nM 6.36
CHEMBL193240 ROFLUMILAST IC50 > 1000.0 nM -
CHEMBL3985784 IC50 > 1000.0 nM -
CHEMBL3948448 IC50 > 1000.0 nM -
CHEMBL3977665 IC50 > 1000.0 nM -
CHEMBL3913876 IC50 > 1000.0 nM -
CHEMBL3941862 IC50 > 1000.0 nM -
CHEMBL3945895 IC50 > 1000.0 nM -
CHEMBL3903408 IC50 > 1000.0 nM -
CHEMBL3922464 IC50 > 1000.0 nM -
CHEMBL3919325 IC50 > 1000.0 nM -
CHEMBL3955694 IC50 > 1000.0 nM -
CHEMBL3984510 IC50 > 1000.0 nM -
CHEMBL3892121 IC50 > 1000.0 nM -
CHEMBL3984674 IC50 - -