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Assay Detail

CHEMBL636768

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

Binding
Binding affinity against Adenosine A1 receptor in rat brain membrane, using [3H]N6-cyclohexyladenosine as the radioligand
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Tissue Brain
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Adenosine receptor A1 (CHEMBL318)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Linear and proximal benzo-separated alkylated xanthines as adenosine-receptor antagonists.
Schneller SW, Ibay AC, Christ WJ, Bruns RF.
J Med Chem (1989) 32 : 2247 -2254
PubMed 2795597 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 22 5.88 7.36

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL11348 1 7.36
CHEMBL62350 8-PHENYL THEOPHYLLINE 1 7.07
CHEMBL72117 1 6.91
CHEMBL312447 1 6.76
CHEMBL73582 1 6.75
CHEMBL310535 1 6.53
CHEMBL72125 1 6.35
CHEMBL157655 1 6.35
CHEMBL306389 1 6.21
CHEMBL309026 1 6.07
CHEMBL275084 ISOBUTYLMETHYLXANTHINE 1 5.60
CHEMBL1355736 THEOPHYLLINE 4.0 1 5.07
CHEMBL73268 1 4.99
CHEMBL419812 1 4.94
CHEMBL72040 1 4.87
CHEMBL72425 1 4.82
CHEMBL307175 1 4.62
CHEMBL113 CAFFEINE 4.0 1 4.54
CHEMBL72254 1 -
CHEMBL72041 1 -
CHEMBL73952 1 -
CHEMBL74063 ISOCAFFIENE 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL11348 Ki = 44.0 nM 7.36
CHEMBL62350 8-PHENYL THEOPHYLLINE Ki = 86.0 nM 7.07
CHEMBL72117 Ki = 123.0 nM 6.91
CHEMBL312447 Ki = 174.0 nM 6.76
CHEMBL73582 Ki = 179.0 nM 6.75
CHEMBL310535 Ki = 296.0 nM 6.53
CHEMBL72125 Ki = 450.0 nM 6.35
CHEMBL157655 Ki = 450.0 nM 6.35
CHEMBL306389 Ki = 620.0 nM 6.21
CHEMBL309026 Ki = 860.0 nM 6.07
CHEMBL275084 ISOBUTYLMETHYLXANTHINE Ki = 2500.0 nM 5.60
CHEMBL1355736 THEOPHYLLINE Ki = 8500.0 nM 5.07
CHEMBL73268 Ki = 10300.0 nM 4.99
CHEMBL419812 Ki = 11600.0 nM 4.94
CHEMBL72040 Ki = 13400.0 nM 4.87
CHEMBL72425 Ki = 15200.0 nM 4.82
CHEMBL307175 Ki = 24000.0 nM 4.62
CHEMBL113 CAFFEINE Ki = 29000.0 nM 4.54
CHEMBL72254 Ki > 100000.0 nM -
CHEMBL72041 Ki > 100000.0 nM -
CHEMBL73952 Ki > 100000.0 nM -
CHEMBL74063 ISOCAFFIENE Ki = 1000000.0 nM -