Compound Detail
CHEMBL545437
AMIBEGRON HYDROCHLORIDE 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL545437 |
| Name | AMIBEGRON HYDROCHLORIDE |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | NQIZCDQCNYCVAS-RQBPZYBGSA-N |
| Parent Compound | CHEMBL1193948 |
| Active Moiety | CHEMBL1193948 |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
4
Known Names
1
Mechanisms
Molecular Properties
403.9
MW (Da)
3.46
ALogP
5
HBA
2
HBD
67.8
PSA (Ų)
0.66
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Beta-3 adrenergic receptor agonist | AGONIST | Beta-3 adrenergic receptor | ✓ | ✓ |
Activity Summary
IC50 4 meas. best 8.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor beta CHEMBL2095166 | IC50 | 8.46 | 7.0025 | 3.5 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor beta | IC50 | = | 3.5 | nM | 8.46 | Beta-adrenergic agonistic activity in rat proximal colon in presence of phentola... | - |
| Adrenergic receptor beta | IC50 | = | 47.0 | nM | 7.33 | Beta-adrenergic agonistic activity in rat proximal colon | - |
| Adrenergic receptor beta | IC50 | = | 499.0 | nM | 6.3 | Beta-adrenergic agonistic activity in rat uterus preincubated with phenoxybenzam... | - |
| Adrenergic receptor beta | IC50 | = | 1200.0 | nM | 5.92 | Beta-adrenergic agonistic activity in rat uterus preincubated with phenoxybenzam... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80535-7 | Adrenergic receptor beta | 6 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine