Compound Detail
CHEMBL3590338
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Basic Information
| ChEMBL ID | CHEMBL3590338 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NGBRPGLXCQJIPU-MISYRCLQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
298.4
MW (Da)
4.81
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.85
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4D CHEMBL288 | IC50 | 5.48 | 5.48 | 3300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4D | IC50 | = | 3300.0 | nM | 5.48 | Inhibition of human PDE4D catalytic domain (86 to 413 residues) expressed in Esc... | 32100544 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26110519 | 10.1021/acs.jnatprod.5b00018 | PC-12 | 1 |
| 32100544 | 10.1021/acs.jnatprod.9b01269 | 3',5'-cyclic-AMP phosphodiesterase 4D | 1 |
Data from ChEMBL 36 via Core Engine