Compound Detail
CHEMBL4279614
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Basic Information
| ChEMBL ID | CHEMBL4279614 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XLOMBPZCCYWZSX-PBHICJAKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
430.3
MW (Da)
3.31
ALogP
3
HBA
1
HBD
56.4
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| cGMP-specific 3',5'-cyclic phosphodiesterase CHEMBL1827 | IC50 | 7.1 | 7.1 | 80.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| cGMP-specific 3',5'-cyclic phosphodiesterase | IC50 | = | 80.2 | nM | 7.1 | Inhibition of full length recombinant human N-terminal GST-tagged PDE5A1 express... | 30245400 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30245400 | 10.1016/j.ejmech.2018.09.028 | cGMP-specific 3',5'-cyclic phosphodiesterase | 2 |
Data from ChEMBL 36 via Core Engine