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Assay Detail

CHEMBL4182273

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Binding
Inhibition of recombinant human PDE2A catalytic domain (580 to 919 residues) expressed in Escherichia coli BL21 (Codonplus) using [3H]cGMP as substrate after 15 mins by liquid scintillation counting method
17
Total Activities
17
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

cGMP-dependent 3',5'-cyclic phosphodiesterase (CHEMBL2652)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of novel purine nucleoside derivatives as phosphodiesterase 2 (PDE2) inhibitors: Structure-based virtual screening, optimization and biological evaluation.
Qiu X, Huang Y, Wu D, Mao F, Zhu J, Yan W, Luo HB, Li J.
Bioorg Med Chem (2018) 26 : 119 -133
PubMed 29174506 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 6.12 6.50

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4215803 1 6.50
CHEMBL4217875 1 6.43
CHEMBL4206935 1 6.39
CHEMBL4206994 1 6.33
CHEMBL4212765 1 6.21
CHEMBL4218153 1 6.17
CHEMBL4213652 1 6.13
CHEMBL4215310 1 5.94
CHEMBL296435 (+)-EHNA 1 5.61
CHEMBL1750 CLOFARABINE 4.0 1 5.51
CHEMBL4207219 1 -
CHEMBL1619 CLADRIBINE 4.0 1 -
CHEMBL285819 1 -
CHEMBL3797375 1 -
CHEMBL4210738 1 -
CHEMBL4208598 1 -
CHEMBL2032002 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4215803 IC50 = 320.0 nM 6.50
CHEMBL4217875 IC50 = 370.0 nM 6.43
CHEMBL4206935 IC50 = 410.0 nM 6.39
CHEMBL4206994 IC50 = 470.0 nM 6.33
CHEMBL4212765 IC50 = 620.0 nM 6.21
CHEMBL4218153 IC50 = 670.0 nM 6.17
CHEMBL4213652 IC50 = 740.0 nM 6.13
CHEMBL4215310 IC50 = 1150.0 nM 5.94
CHEMBL296435 (+)-EHNA IC50 = 2460.0 nM 5.61
CHEMBL1750 CLOFARABINE IC50 = 3120.0 nM 5.51
CHEMBL4207219 IC50 > 10000.0 nM -
CHEMBL1619 CLADRIBINE IC50 > 10000.0 nM -
CHEMBL285819 IC50 > 10000.0 nM -
CHEMBL3797375 IC50 > 10000.0 nM -
CHEMBL4210738 IC50 > 10000.0 nM -
CHEMBL4208598 IC50 > 10000.0 nM -
CHEMBL2032002 IC50 > 10000.0 nM -