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Assay Detail

CHEMBL1251995

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

Binding
Binding affinity to Lucilia cuprina recombinant ecdysone receptor ligand binding domain after 3 hrs by fluorescence polarization assay
24
Total Activities
24
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Lucilia cuprina
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Ecdysone receptor (CHEMBL1250403)
Type SINGLE PROTEIN
Organism Lucilia cuprina

Publication

Synthesis, binding and bioactivity of gamma-methylene gamma-lactam ecdysone receptor ligands: advantages of QSAR models for flexible receptors.
Birru W, Fernley RT, Graham LD, Grusovin J, Hill RJ, Hofmann A, Howell L, James PJ, Jarvis KE, Johnson WM, Jones DA, Leitner C, Liepa AJ, Lovrecz GO, Lu L, Nearn RH, O'Driscoll BJ, Phan T, Pollard M, Turner KA, Winkler DA.
Bioorg Med Chem (2010) 18 : 5647 -5660
PubMed 20619664 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 4.85 6.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL549789 PONASTERONE A 1 6.05
CHEMBL224128 20-HYDROXYECDYSONE 2.0 1 5.26
CHEMBL1253938 1 5.26
CHEMBL1254948 1 5.26
CHEMBL1254213 1 5.19
CHEMBL1253279 1 5.14
CHEMBL1254864 1 5.08
CHEMBL1254453 1 5.07
CHEMBL1253195 1 4.96
CHEMBL1254865 1 4.90
CHEMBL1254214 1 4.90
CHEMBL1254690 1 4.82
CHEMBL1254303 1 4.76
CHEMBL1254374 1 4.63
CHEMBL1253760 1 4.56
CHEMBL1255029 1 4.48
CHEMBL1254691 1 4.38
CHEMBL1254692 1 4.33
CHEMBL1253617 1 4.32
CHEMBL1254031 1 4.26
CHEMBL1254949 1 4.25
CHEMBL1253939 1 -
CHEMBL1254537 1 -
CHEMBL1254774 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL549789 PONASTERONE A IC50 = 900.0 nM 6.05
CHEMBL224128 20-HYDROXYECDYSONE IC50 = 5500.0 nM 5.26
CHEMBL1253938 IC50 = 5500.0 nM 5.26
CHEMBL1254948 IC50 = 5500.0 nM 5.26
CHEMBL1254213 IC50 = 6500.0 nM 5.19
CHEMBL1253279 IC50 = 7250.0 nM 5.14
CHEMBL1254864 IC50 = 8300.0 nM 5.08
CHEMBL1254453 IC50 = 8500.0 nM 5.07
CHEMBL1253195 IC50 = 11000.0 nM 4.96
CHEMBL1254865 IC50 = 12500.0 nM 4.90
CHEMBL1254214 IC50 = 12500.0 nM 4.90
CHEMBL1254690 IC50 = 15000.0 nM 4.82
CHEMBL1254303 IC50 = 17500.0 nM 4.76
CHEMBL1254374 IC50 = 23500.0 nM 4.63
CHEMBL1253760 IC50 = 27500.0 nM 4.56
CHEMBL1255029 IC50 = 33000.0 nM 4.48
CHEMBL1254691 IC50 = 42000.0 nM 4.38
CHEMBL1254692 IC50 = 47000.0 nM 4.33
CHEMBL1253617 IC50 = 48000.0 nM 4.32
CHEMBL1254031 IC50 = 55000.0 nM 4.26
CHEMBL1254949 IC50 = 56000.0 nM 4.25
CHEMBL1253939 IC50 = 175000.0 nM -
CHEMBL1254537 IC50 = 250000.0 nM -
CHEMBL1254774 IC50 = 480000.0 nM -