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Assay Detail

CHEMBL3888705

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

Binding
Fluorescence Polarization Assay: PDE activity was measured using the IMAP fluorescence polarization assay (Molecular Devices) in which binding of hydrolyzed cyclic nucleotide substrate to immobilized metal coordination complexes increases fluorescence polarization (FP). Tetramethylrhodamine (TAMRA)-cGMP and fluorescein-cAMP were used as substrates, each at final concentration of 50 nmol/L. The PDE assay was done according to the manufacturer's specifications using either whole cell lysates or recombinant enzymes. FP was measured at excitation, emission wavelengths of either 530,590 nm for TAMRA-cGMP or 485,530 nm for fluorescein-cAMP using a Synergy4 (Biotek) microplate reader.
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

cGMP-specific 3',5'-cyclic phosphodiesterase (CHEMBL1827)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Derivatives of celeboxib, use thereof and preparation thereof
(2016)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 5.35 5.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3979746 1 5.92
CHEMBL3912685 1 5.75
CHEMBL3909725 1 5.72
CHEMBL3918044 1 5.70
CHEMBL3912663 1 5.70
CHEMBL3323320 1 5.68
CHEMBL3963234 1 5.57
CHEMBL3976289 1 5.54
CHEMBL3954425 1 5.51
CHEMBL3960150 1 5.51
CHEMBL3927064 1 5.50
CHEMBL3937157 1 5.50
CHEMBL3921118 1 5.48
CHEMBL3906921 1 5.48
CHEMBL3899621 1 5.43
CHEMBL1370630 1 5.42
CHEMBL3893185 1 5.26
CHEMBL3914590 1 5.24
CHEMBL3918115 1 5.21
CHEMBL3922249 1 5.16
CHEMBL3926786 1 5.16
CHEMBL3963184 1 5.14
CHEMBL3908967 1 5.11
CHEMBL3965079 1 5.08
CHEMBL3910060 1 5.06
CHEMBL3931444 1 5.00
CHEMBL3909240 1 4.63
CHEMBL118 CELECOXIB 4.0 1 4.44

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3979746 IC50 = 1200.0 nM 5.92
CHEMBL3912685 IC50 = 1800.0 nM 5.75
CHEMBL3909725 IC50 = 1900.0 nM 5.72
CHEMBL3918044 IC50 = 2020.0 nM 5.70
CHEMBL3912663 IC50 = 2000.0 nM 5.70
CHEMBL3323320 IC50 = 2100.0 nM 5.68
CHEMBL3963234 IC50 = 2700.0 nM 5.57
CHEMBL3976289 IC50 = 2900.0 nM 5.54
CHEMBL3954425 IC50 = 3100.0 nM 5.51
CHEMBL3960150 IC50 = 3100.0 nM 5.51
CHEMBL3927064 IC50 = 3200.0 nM 5.50
CHEMBL3937157 IC50 = 3200.0 nM 5.50
CHEMBL3921118 IC50 = 3300.0 nM 5.48
CHEMBL3906921 IC50 = 3300.0 nM 5.48
CHEMBL3899621 IC50 = 3700.0 nM 5.43
CHEMBL1370630 IC50 = 3800.0 nM 5.42
CHEMBL3893185 IC50 = 5500.0 nM 5.26
CHEMBL3914590 IC50 = 5700.0 nM 5.24
CHEMBL3918115 IC50 = 6220.0 nM 5.21
CHEMBL3922249 IC50 = 6900.0 nM 5.16
CHEMBL3926786 IC50 = 6900.0 nM 5.16
CHEMBL3963184 IC50 = 7200.0 nM 5.14
CHEMBL3908967 IC50 = 7700.0 nM 5.11
CHEMBL3965079 IC50 = 8400.0 nM 5.08
CHEMBL3910060 IC50 = 8700.0 nM 5.06
CHEMBL3931444 IC50 = 9900.0 nM 5.00
CHEMBL3909240 IC50 = 23500.0 nM 4.63
CHEMBL118 CELECOXIB IC50 = 36000.0 nM 4.44