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Assay Detail

CHEMBL3428930

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Functional
Agonist activity at human beta2 adrenergic receptor expressed in HEK293 cells assessed as cAMP accumulation using [125I]cAMP by scintillation counting
26
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Beta-2 adrenergic receptor (CHEMBL210)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of (R)-1-(3-((2-chloro-4-(((2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl)amino)methyl)-5-methoxyphenyl)amino)-3-oxopropyl)piperidin-4-yl [1,1'-biphenyl]-2-ylcarbamate (TD-5959, GSK961081, batefenterol): first-in-class dual pharmacology multivalent muscarinic antagonist and β₂ agonist (MABA) for the treatment of chronic obstructive pulmonary disease (COPD).
Hughes AD, Chen Y, Hegde SS, Jasper JR, Jaw-Tsai S, Lee TW, McNamara A, Pulido-Rios MT, Steinfeld T, Mammen M.
J Med Chem (2015) 58 : 2609 -2622
PubMed 25629394 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 26 9.34 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3426706 1 10.00
CHEMBL3426697 1 9.90
CHEMBL3426701 1 9.80
CHEMBL3426698 1 9.80
CHEMBL3426693 1 9.70
CHEMBL3426694 1 9.70
CHEMBL3426687 1 9.60
CHEMBL3426688 1 9.60
CHEMBL3426691 1 9.60
CHEMBL3039518 BATEFENTEROL 2.0 1 9.60
CHEMBL3426695 1 9.60
CHEMBL3426702 1 9.60
CHEMBL3426696 1 9.50
CHEMBL1683934 1 9.40
CHEMBL3426692 1 9.40
CHEMBL3426699 1 9.30
CHEMBL3426690 1 9.30
CHEMBL3426689 1 9.30
CHEMBL1346 DARIFENACIN 4.0 1 9.10
CHEMBL3426703 1 9.10
CHEMBL3426708 1 9.10
CHEMBL3426707 1 8.90
CHEMBL3426700 1 8.80
CHEMBL3426705 1 8.40
CHEMBL3426704 1 7.30
CHEMBL1900528 TIOTROPIUM 4.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3426706 EC50 = 0.1 nM 10.00
CHEMBL3426697 EC50 = 0.1259 nM 9.90
CHEMBL3426701 EC50 = 0.1585 nM 9.80
CHEMBL3426698 EC50 = 0.1585 nM 9.80
CHEMBL3426693 EC50 = 0.1995 nM 9.70
CHEMBL3426694 EC50 = 0.1995 nM 9.70
CHEMBL3426687 EC50 = 0.2512 nM 9.60
CHEMBL3426688 EC50 = 0.2512 nM 9.60
CHEMBL3426691 EC50 = 0.2512 nM 9.60
CHEMBL3039518 BATEFENTEROL EC50 = 0.2512 nM 9.60
CHEMBL3426695 EC50 = 0.2512 nM 9.60
CHEMBL3426702 EC50 = 0.2512 nM 9.60
CHEMBL3426696 EC50 = 0.3162 nM 9.50
CHEMBL1683934 EC50 = 0.3981 nM 9.40
CHEMBL3426692 EC50 = 0.3981 nM 9.40
CHEMBL3426699 EC50 = 0.5012 nM 9.30
CHEMBL3426690 EC50 = 0.5012 nM 9.30
CHEMBL3426689 EC50 = 0.5012 nM 9.30
CHEMBL1346 DARIFENACIN EC50 = 0.7943 nM 9.10
CHEMBL3426703 EC50 = 0.7943 nM 9.10
CHEMBL3426708 EC50 = 0.7943 nM 9.10
CHEMBL3426707 EC50 = 1.259 nM 8.90
CHEMBL3426700 EC50 = 1.585 nM 8.80
CHEMBL3426705 EC50 = 3.981 nM 8.40
CHEMBL3426704 EC50 = 50.12 nM 7.30
CHEMBL1900528 TIOTROPIUM EC50 > 10000.0 nM -