Compound Detail
CHEMBL332750
TETOMILAST 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL332750 |
| Name | TETOMILAST |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | XDBHURGONHZNJF-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
2
Known Names
3
Indications
1
Mechanisms
Molecular Properties
370.4
MW (Da)
4.37
ALogP
6
HBA
1
HBD
81.5
PSA (Ų)
0.67
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Phosphodiesterase 4 inhibitor | INHIBITOR | Phosphodiesterase 4 | ✓ | ✓ |
Indications
Colitis, Ulcerative Crohn Disease Pulmonary Disease, Chronic Obstructive
Activity Summary
IC50 3 meas. best 7.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3',5'-cyclic-AMP phosphodiesterase 4D CHEMBL288 | IC50 | 7.16 | 7.16 | 70.0 | 1 |
| Homo sapiens CHEMBL372 | IC50 | 7.16 | 7.16 | 70.0 | 1 |
| Phosphodiesterase 4 CHEMBL2093863 | IC50 | 7.13 | 7.13 | 74.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Homo sapiens | IC50 | = | 70.0 | nM | 7.16 | In vitro inhibitory activity against superoxide production from human neutrophil... | 7830278 |
| 3',5'-cyclic-AMP phosphodiesterase 4D | IC50 | = | 70.0 | nM | 7.16 | Inhibition of human PDE4D catalytic domain using [3H]-cAMP or [3H]-cGMP incubate... | - |
| Phosphodiesterase 4 | IC50 | = | 74.0 | nM | 7.13 | Inhibition of PDE4 (unknown origin) | 32255344 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7830278 | 10.1021/jm00002a017 | Homo sapiens | 1 |
| 7830278 | 10.1021/jm00002a017 | No relevant target | 1 |
| 32255344 | 10.1021/acs.jmedchem.9b02170 | Phosphodiesterase 4 | 1 |
Data from ChEMBL 36 via Core Engine