Compound Detail
CHEMBL88153
CDC-801 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL88153 |
| Name | CDC-801 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | DDYUBCCTNHWSQM-UHFFFAOYSA-N |
4
Targets
6
Activities
1
Assay Types
0
PK Parameters
7
Publications
3
Known Names
2
Indications
Molecular Properties
408.4
MW (Da)
3.23
ALogP
5
HBA
1
HBD
98.9
PSA (Ų)
0.71
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Indications
Myelodysplastic Syndromes Leukemia
Activity Summary
IC50 6 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 4 CHEMBL2093863 | IC50 | 5.96 | 5.96 | 1100.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
| PBMC CHEMBL613107 | IC50 | 5.6 | 5.6 | 2500.0 | 2 |
| Blood CHEMBL613416 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 4 | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of PDE4 enzyme from U937 cells | 9873600 |
| Unchecked | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of PDE4 | 18686943 |
| Phosphodiesterase 4 | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of human PDE4 | 19256507 |
| PBMC | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of LPS stimulated Tumor Necrosis Factor-alpha (TNF-alpha) release by ... | 9873600 |
| Blood | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of TNFalpha release in human whole blood | 18686943 |
| PBMC | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of TNFalpha production in LPS-stimulated human PBMC preincubated befo... | 19256507 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9873600 | 10.1016/s0960-894x(98)00475-2 | PBMC | 1 |
| 9873600 | 10.1016/s0960-894x(98)00475-2 | Phosphodiesterase 4 | 1 |
| 18686943 | 10.1021/jm800582j | Blood | 1 |
| 18686943 | 10.1021/jm800582j | Unchecked | 1 |
| 19256507 | 10.1021/jm900210d | Phosphodiesterase 4 | 1 |
| 19256507 | 10.1021/jm900210d | PBMC | 1 |
| 19256507 | 10.1021/jm900210d | Blood | 1 |
Data from ChEMBL 36 via Core Engine