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Assay Detail

CHEMBL991729

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

Binding
Displacement of [3H]NECA from Sprague-Dawley rat adenosine A2A receptor by scintillation counting
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Adenosine receptor A2a (CHEMBL302)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Dual inhibition of monoamine oxidase B and antagonism of the adenosine A(2A) receptor by (E,E)-8-(4-phenylbutadien-1-yl)caffeine analogues.
Pretorius J, Malan SF, Castagnoli N, Bergh JJ, Petzer JP.
Bioorg Med Chem (2008) 16 : 8676 -8684
PubMed 18723354 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 10 7.30 8.56

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL489592 1 8.56
CHEMBL431770 ISTRADEFYLLINE 4.0 1 8.35
CHEMBL490014 1 8.11
CHEMBL446316 1 7.87
CHEMBL483243 1 7.52
CHEMBL522256 1 7.23
CHEMBL489390 1 6.98
CHEMBL489391 1 6.94
CHEMBL483663 1 6.82
CHEMBL113 CAFFEINE 4.0 1 4.66

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL489592 Ki = 2.74 nM 8.56
CHEMBL431770 ISTRADEFYLLINE Ki = 4.46 nM 8.35
CHEMBL490014 Ki = 7.73 nM 8.11
CHEMBL446316 Ki = 13.5 nM 7.87
CHEMBL483243 Ki = 30.2 nM 7.52
CHEMBL522256 Ki = 59.1 nM 7.23
CHEMBL489390 Ki = 104.0 nM 6.98
CHEMBL489391 Ki = 114.0 nM 6.94
CHEMBL483663 Ki = 153.0 nM 6.82
CHEMBL113 CAFFEINE Ki = 22000.0 nM 4.66