Compound Detail
CHEMBL3315082
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Basic Information
| ChEMBL ID | CHEMBL3315082 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BHSKOINIMXXGFJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
12
Publications
0
Known Names
Molecular Properties
400.2
MW (Da)
3.29
ALogP
6
HBA
1
HBD
95.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4D CHEMBL288 | IC50 | 5.42 | 5.42 | 3760.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4D | IC50 | = | 3760.0 | nM | 5.42 | Inhibition of human recombinant PDE4D after 1 hr by SPA in presence of radioacti... | 24984230 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24984230 | 10.1021/jm500378a | 3',5'-cyclic-AMP phosphodiesterase 4D | 1 |
| 24984230 | 10.1021/jm500378a | PBMC | 1 |
| 24984230 | 10.1021/jm500378a | Liver microsome | 1 |
| 24984230 | 10.1021/jm500378a | Phosphodiesterase 1 | 1 |
| 24984230 | 10.1021/jm500378a | cGMP-dependent 3',5'-cyclic phosphodiesterase | 1 |
| 24984230 | 10.1021/jm500378a | Phosphodiesterase 3 | 1 |
| 24984230 | 10.1021/jm500378a | cGMP-specific 3',5'-cyclic phosphodiesterase | 1 |
| 24984230 | 10.1021/jm500378a | High affinity 3',5'-cyclic-AMP phosphodiesterase 7A | 1 |
| 24984230 | 10.1021/jm500378a | Phosphodiesterase 8 | 1 |
| 24984230 | 10.1021/jm500378a | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | 1 |
| 24984230 | 10.1021/jm500378a | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 1 |
| 24984230 | 10.1021/jm500378a | Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A | 1 |
Data from ChEMBL 36 via Core Engine