Compound Detail
CHEMBL4072582
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
O=C1c2ccccc2NC(c2ccccc2F)N1CCOc1ccc(N2C(=O)c3ccccc3NC2c2ccccc2F)cc1
Basic Information
| ChEMBL ID | CHEMBL4072582 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QTQHWXCHQNSLSI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
602.6
MW (Da)
7.38
ALogP
5
HBA
2
HBD
73.9
PSA (Ų)
0.20
QED
2
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 7.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta CHEMBL3860 | Kd | 7.8 | 7.8 | 16.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta | Kd | = | 16.0 | nM | 7.8 | Inhibition of Atrovastatin-PEG3-FITC binding to PDEdelta (unknown origin) incuba... | 28929751 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28929751 | 10.1021/acs.jmedchem.7b01243 | Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta | 1 |
| 28929751 | 10.1021/acs.jmedchem.7b01243 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine