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Assay Detail

CHEMBL1909214

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

Binding
DRUGMATRIX: Adenosine A2A radioligand binding (ligand: AB-MECA)
1742
Total Activities
871
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Cell Type HEK293
Subcellular Membrane
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

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

Publication

DrugMatrix in vitro pharmacology data
Scott S. Auerbach, DrugMatrix¨ and ToxFX¨ Coordinator National Toxicology Program

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 871 5.26 6.60
Ki 871 5.52 6.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL192 SILDENAFIL 4.0 2 6.85
CHEMBL115769 2 6.24
CHEMBL290106 BITHIONOL 4.0 2 6.18
CHEMBL1475 TRIOXSALEN 4.0 2 6.13
CHEMBL42442 OXFENDAZOLE 2.0 2 6.07
CHEMBL496 HEXACHLOROPHENE 4.0 2 6.04
CHEMBL81 RALOXIFENE 4.0 2 5.93
CHEMBL64894 GENTIAN VIOLET 4.0 2 5.72
CHEMBL1726 NISOLDIPINE 4.0 2 5.64
CHEMBL1282 IMIQUIMOD 4.0 2 5.53
CHEMBL10 SB-203580 2 5.47
CHEMBL83 TAMOXIFEN 4.0 2 5.40
CHEMBL9514 NOCODAZOLE 2.0 2 5.38
CHEMBL411 DIETHYLSTILBESTROL 4.0 2 5.30
CHEMBL1355736 THEOPHYLLINE 4.0 2 5.17
CHEMBL104 CLOTRIMAZOLE 4.0 2 5.15
CHEMBL91 MICONAZOLE 4.0 2 5.10
CHEMBL808 ECONAZOLE 4.0 2 5.09
CHEMBL44 GENISTEIN 2.0 2 5.01
CHEMBL113 CAFFEINE 4.0 2 4.94
CHEMBL691 ETHINYL ESTRADIOL 4.0 2 4.93
CHEMBL195437 4-OCTYLPHENOL 2 4.90
CHEMBL434063 2 4.68
CHEMBL1095699 AZASERINE 2.0 2 -
CHEMBL701 BACLOFEN 4.0 2 -
CHEMBL221753 BENZETHONIUM CHLORIDE 2.0 2 -
CHEMBL12089 BERBERINE CHLORIDE 1.0 2 -
CHEMBL1231530 BETAMIPRON 2.0 2 -
CHEMBL1077 BROMFENAC 4.0 2 -
CHEMBL894 BUPROPION 4.0 2 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL192 SILDENAFIL Ki = 142.0 nM 6.85
CHEMBL192 SILDENAFIL IC50 = 253.0 nM 6.60
CHEMBL115769 Ki = 580.0 nM 6.24
CHEMBL290106 BITHIONOL Ki = 655.0 nM 6.18
CHEMBL1475 TRIOXSALEN Ki = 737.0 nM 6.13
CHEMBL42442 OXFENDAZOLE Ki = 844.0 nM 6.07
CHEMBL496 HEXACHLOROPHENE Ki = 906.0 nM 6.04
CHEMBL115769 IC50 = 1032.0 nM 5.99
CHEMBL290106 BITHIONOL IC50 = 1167.0 nM 5.93
CHEMBL81 RALOXIFENE Ki = 1185.0 nM 5.93
CHEMBL1475 TRIOXSALEN IC50 = 1312.0 nM 5.88
CHEMBL42442 OXFENDAZOLE IC50 = 1504.0 nM 5.82
CHEMBL496 HEXACHLOROPHENE IC50 = 1613.8 nM 5.79
CHEMBL64894 GENTIAN VIOLET Ki = 1889.0 nM 5.72
CHEMBL81 RALOXIFENE IC50 = 2111.0 nM 5.68
CHEMBL1726 NISOLDIPINE Ki = 2278.0 nM 5.64
CHEMBL1282 IMIQUIMOD Ki = 2987.0 nM 5.53
CHEMBL64894 GENTIAN VIOLET IC50 = 3365.0 nM 5.47
CHEMBL10 SB-203580 Ki = 3407.0 nM 5.47
CHEMBL83 TAMOXIFEN Ki = 3985.0 nM 5.40
CHEMBL1726 NISOLDIPINE IC50 = 4058.0 nM 5.39
CHEMBL9514 NOCODAZOLE Ki = 4219.0 nM 5.38
CHEMBL411 DIETHYLSTILBESTROL Ki = 5060.0 nM 5.30
CHEMBL1282 IMIQUIMOD IC50 = 5320.0 nM 5.27
CHEMBL10 SB-203580 IC50 = 6068.0 nM 5.22
CHEMBL1355736 THEOPHYLLINE Ki = 6741.0 nM 5.17
CHEMBL83 TAMOXIFEN IC50 = 7099.0 nM 5.15
CHEMBL104 CLOTRIMAZOLE Ki = 7136.0 nM 5.15
CHEMBL9514 NOCODAZOLE IC50 = 7509.0 nM 5.12
CHEMBL91 MICONAZOLE Ki = 8002.0 nM 5.10
CHEMBL808 ECONAZOLE Ki = 8206.0 nM 5.09
CHEMBL411 DIETHYLSTILBESTROL IC50 = 9013.0 nM 5.04
CHEMBL44 GENISTEIN Ki = 9792.0 nM 5.01
CHEMBL113 CAFFEINE Ki = 11493.0 nM 4.94
CHEMBL691 ETHINYL ESTRADIOL Ki = 11751.0 nM 4.93
CHEMBL1355736 THEOPHYLLINE IC50 = 12007.0 nM 4.92
CHEMBL195437 4-OCTYLPHENOL Ki = 12593.0 nM 4.90
CHEMBL104 CLOTRIMAZOLE IC50 = 12711.0 nM 4.90
CHEMBL91 MICONAZOLE IC50 = 14253.0 nM 4.85
CHEMBL808 ECONAZOLE IC50 = 14616.0 nM 4.83
CHEMBL44 GENISTEIN IC50 = 17442.0 nM 4.76
CHEMBL113 CAFFEINE IC50 = 20472.0 nM 4.69
CHEMBL691 ETHINYL ESTRADIOL IC50 = 20931.0 nM 4.68
CHEMBL434063 Ki = 20915.0 nM 4.68
CHEMBL195437 4-OCTYLPHENOL IC50 = 22432.0 nM 4.65
CHEMBL434063 IC50 = 37254.0 nM 4.43
CHEMBL1909071 IC50 - -
CHEMBL286398 PROPYLENE GLYCOL IC50 - -
CHEMBL286398 PROPYLENE GLYCOL Ki - -
CHEMBL1221512 IC50 - -