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Assay Detail

CHEMBL5339428

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

Binding
Inhibition of recombinant PDE4D2 (86 to 413 residues) (unknown origin) expressed in Escherichia coli BL21 using [3H]cAMP as substrate incubated for 15 mins by liquid scintillation method
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

3',5'-cyclic-AMP phosphodiesterase 4D (CHEMBL288)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of novel PDE4 inhibitors targeting the M-pocket from natural mangostanin with improved safety for the treatment of Inflammatory Bowel Diseases.
Liu H, Wang Q, Huang Y, Deng J, Xie X, Zhu J, Yuan Y, He YM, Huang YY, Luo HB, He X.
Eur J Med Chem (2022) 242 : 114631 -114631
PubMed 35985255 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 19 7.84 8.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5400816 1 8.85
CHEMBL5431083 1 8.85
CHEMBL5407967 1 8.46
CHEMBL5408080 1 8.28
CHEMBL5421333 1 8.19
CHEMBL5420700 1 8.11
CHEMBL5440771 1 8.09
CHEMBL5435764 1 8.03
CHEMBL5434362 1 7.99
CHEMBL5434713 1 7.97
CHEMBL5438159 1 7.93
CHEMBL5410553 1 7.91
CHEMBL5405731 1 7.70
CHEMBL5437810 1 7.60
CHEMBL5428117 1 6.69
CHEMBL561643 MANGOSTANIN 1 6.38
CHEMBL63 ROLIPRAM 2.0 1 6.23
CHEMBL5420621 1 -
CHEMBL5437828 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5400816 IC50 = 1.4 nM 8.85
CHEMBL5431083 IC50 = 1.4 nM 8.85
CHEMBL5407967 IC50 = 3.5 nM 8.46
CHEMBL5408080 IC50 = 5.2 nM 8.28
CHEMBL5421333 IC50 = 6.5 nM 8.19
CHEMBL5420700 IC50 = 7.8 nM 8.11
CHEMBL5440771 IC50 = 8.2 nM 8.09
CHEMBL5435764 IC50 = 9.3 nM 8.03
CHEMBL5434362 IC50 = 10.2 nM 7.99
CHEMBL5434713 IC50 = 10.6 nM 7.97
CHEMBL5438159 IC50 = 11.7 nM 7.93
CHEMBL5410553 IC50 = 12.4 nM 7.91
CHEMBL5405731 IC50 = 20.2 nM 7.70
CHEMBL5437810 IC50 = 25.0 nM 7.60
CHEMBL5428117 IC50 = 203.0 nM 6.69
CHEMBL561643 MANGOSTANIN IC50 = 420.0 nM 6.38
CHEMBL63 ROLIPRAM IC50 = 590.0 nM 6.23
CHEMBL5420621 IC50 > 1000.0 nM -
CHEMBL5437828 IC50 > 1000.0 nM -