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Assay Detail

CHEMBL4041342

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

Binding
Inhibition of recombinant human full-length His-tagged PDE2A3 expressed in fall armyworm Sf9 cells using [3H]cGMP as substrate preincubated for 30 mins followed by substrate addition measured after 60 mins by scintillation counting
36
Total Activities
33
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 Clinical Candidate N-((1S)-1-(3-Fluoro-4-(trifluoromethoxy)phenyl)-2-methoxyethyl)-7-methoxy-2-oxo-2,3-dihydropyrido[2,3-b]pyrazine-4(1H)-carboxamide (TAK-915): A Highly Potent, Selective, and Brain-Penetrating Phosphodiesterase 2A Inhibitor for the Treatment of Cognitive Disorders.
Mikami S, Nakamura S, Ashizawa T, Nomura I, Kawasaki M, Sasaki S, Oki H, Kokubo H, Hoffman ID, Zou H, Uchiyama N, Nakashima K, Kamiguchi N, Imada H, Suzuki N, Iwashita H, Taniguchi T.
J Med Chem (2017) 60 : 7677 -7702
PubMed 28796496 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 36 6.86 9.21

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4060569 TAK-915 1.0 1 9.21
CHEMBL4102321 1 8.80
CHEMBL4064402 1 8.55
CHEMBL4072982 1 8.46
CHEMBL4067117 2 8.14
CHEMBL4085207 1 8.06
CHEMBL4098223 1 7.72
CHEMBL4079459 1 7.68
CHEMBL4068452 1 7.62
CHEMBL4097310 1 7.54
CHEMBL4093680 1 7.48
CHEMBL4082199 1 7.40
CHEMBL4078948 1 7.38
CHEMBL4088107 1 7.28
CHEMBL4081720 1 7.21
CHEMBL4089589 1 7.19
CHEMBL4064344 3 7.18
CHEMBL4073981 1 7.14
CHEMBL4085934 1 7.11
CHEMBL4094525 1 7.10
CHEMBL4063592 1 7.07
CHEMBL4071171 1 6.68
CHEMBL4059794 1 6.60
CHEMBL4087340 1 6.32
CHEMBL4084307 1 6.30
CHEMBL4072924 1 6.21
CHEMBL4082451 1 6.04
CHEMBL4102271 1 5.39
CHEMBL4089762 1 5.19
CHEMBL4103219 1 5.09

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4060569 TAK-915 IC50 = 0.61 nM 9.21
CHEMBL4102321 IC50 = 1.6 nM 8.80
CHEMBL4064402 IC50 = 2.8 nM 8.55
CHEMBL4072982 IC50 = 3.5 nM 8.46
CHEMBL4067117 IC50 = 7.2 nM 8.14
CHEMBL4085207 IC50 = 8.7 nM 8.06
CHEMBL4098223 IC50 = 19.0 nM 7.72
CHEMBL4079459 IC50 = 21.0 nM 7.68
CHEMBL4068452 IC50 = 24.0 nM 7.62
CHEMBL4097310 IC50 = 29.0 nM 7.54
CHEMBL4093680 IC50 = 33.0 nM 7.48
CHEMBL4082199 IC50 = 40.0 nM 7.40
CHEMBL4078948 IC50 = 42.0 nM 7.38
CHEMBL4088107 IC50 = 53.0 nM 7.28
CHEMBL4081720 IC50 = 62.0 nM 7.21
CHEMBL4089589 IC50 = 65.0 nM 7.19
CHEMBL4064344 IC50 = 66.0 nM 7.18
CHEMBL4073981 IC50 = 72.0 nM 7.14
CHEMBL4064344 IC50 = 78.0 nM 7.11
CHEMBL4085934 IC50 = 77.0 nM 7.11
CHEMBL4094525 IC50 = 80.0 nM 7.10
CHEMBL4063592 IC50 = 85.0 nM 7.07
CHEMBL4071171 IC50 = 210.0 nM 6.68
CHEMBL4059794 IC50 = 250.0 nM 6.60
CHEMBL4087340 IC50 = 480.0 nM 6.32
CHEMBL4084307 IC50 = 500.0 nM 6.30
CHEMBL4072924 IC50 = 610.0 nM 6.21
CHEMBL4082451 IC50 = 910.0 nM 6.04
CHEMBL4102271 IC50 = 4100.0 nM 5.39
CHEMBL4089762 IC50 = 6500.0 nM 5.19
CHEMBL4103219 IC50 = 8100.0 nM 5.09
CHEMBL4068646 IC50 = 19000.0 nM 4.72
CHEMBL4067117 IC50 = 21000.0 nM 4.68
CHEMBL4078053 IC50 = 39000.0 nM 4.41
CHEMBL4092061 IC50 = 70000.0 nM 4.16
CHEMBL4064344 IC50 > 100000.0 nM -