Compound Detail
CHEMBL1501511
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Basic Information
| ChEMBL ID | CHEMBL1501511 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OFWPFMDXRGTHFT-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
215.7
MW (Da)
1.78
ALogP
5
HBA
2
HBD
62.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.9
IC50 1 meas. best 6.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4A CHEMBL254 | IC50 | 6.61 | 6.61 | 245.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.9 | 4.9 | 12682.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4A | IC50 | = | 245.0 | nM | 6.61 | Inhibition of human full length PDE4A4 expressed in baculovirus infected sf21 ce... | 23806553 |
| Unchecked | EC50 | = | 12682.0 | nM | 4.9 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Inhibito... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23806553 | 10.1016/j.bmcl.2013.05.099 | 3',5'-cyclic-AMP phosphodiesterase 4A | 1 |
Data from ChEMBL 36 via Core Engine