Compound Detail
CHEMBL24646
PIMOBENDAN 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL24646 |
| Name | PIMOBENDAN |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | GLBJJMFZWDBELO-UHFFFAOYSA-N |
5
Targets
9
Activities
2
Assay Types
5
PK Parameters
20
Publications
10
Known Names
Molecular Properties
334.4
MW (Da)
3.10
ALogP
4
HBA
2
HBD
79.4
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Activity Summary
IC50 6 meas. best 6.39
EC50 3 meas. best 5.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 3 CHEMBL2094125 | IC50 | 6.39 | 5.555 | 410.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 5.54 | 5.3133 | 2892.1 | 3 |
| Aorta CHEMBL613606 | EC50 | 5.33 | 5.33 | 4670.0 | 1 |
| Type-1 angiotensin II receptor CHEMBL3374 | IC50 | 4.77 | 4.77 | 17000.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 4.0 | 4.0 | 100000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 14.0 | mL.min-1.kg-1 | Homo sapiens |
| CL | 14.0 | mL.min-1.g-1 | Homo sapiens |
| Fu | 0.024 | - | Homo sapiens |
| MRT | 2.2 | hr | Homo sapiens |
| T1/2 | 1.8 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 3 | IC50 | = | 410.0 | nM | 6.39 | Inhibition of phosphodiesterase 3 | - |
| Unchecked | IC50 | = | 2892.1 | nM | 5.54 | PubChem BioAssay. VEGF stimulated ADSC/ECFC co-culture CD31-stained tube area de... | - |
| Aorta | EC50 | = | 4670.0 | nM | 5.33 | Vasorelaxant activity in Wistar rat endothelium-intact thoracic aortic ring asse... | 20451399 |
| Unchecked | IC50 | = | 5549.1 | nM | 5.26 | PubChem BioAssay. alkaline phosphatase stimulation in WNT3A conditioned C2C12 ce... | - |
| Unchecked | IC50 | = | 7226.1 | nM | 5.14 | PubChem BioAssay. Decreased HeLa cell count-IC50. (Class of assay: confirmator... | - |
| Type-1 angiotensin II receptor | IC50 | = | 17000.0 | nM | 4.77 | Concentration required for 50% inhibition of binding against Angiotensin II rece... | - |
| Phosphodiesterase 3 | IC50 | = | 19000.0 | nM | 4.72 | Inhibition of phosphodiesterase 3 | - |
| NON-PROTEIN TARGET | EC50 | = | 100000.0 | nM | 4.0 | Calcium sensitizing activity | - |
Literature References
Data from ChEMBL 36 via Core Engine