Compound Detail
CHEMBL3360414
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Basic Information
| ChEMBL ID | CHEMBL3360414 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BXGYEZMSXWEQLG-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
382.4
MW (Da)
2.29
ALogP
7
HBA
3
HBD
113.9
PSA (Ų)
0.60
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A CHEMBL3535 | IC50 | 8.26 | 8.24 | 5.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | IC50 | = | 5.5 | nM | 8.26 | Inhibition of PDE9A2 catalytic domain (unknown origin) using [3H]-cGMP/[3H]-cAMP... | 25432025 |
| High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | IC50 | = | 6.0 | nM | 8.22 | Inhibition Assay: Inhibition activities of all the N-substituted pyrazolo [3,4-d... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25432025 | 10.1021/jm500836h | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | 1 |
Data from ChEMBL 36 via Core Engine