Compound Detail
CHEMBL1921904
AZD-9164 🧪 Phase II
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🧪 Phase II
C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc(F)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1
Basic Information
| ChEMBL ID | CHEMBL1921904 |
| Name | AZD-9164 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | FNYFFCOCVNTJCD-NNMXADRKSA-N |
2
Targets
2
Activities
2
Assay Types
2
PK Parameters
6
Publications
4
Known Names
1
Indications
1
Mechanisms
Molecular Properties
465.6
MW (Da)
4.92
ALogP
3
HBA
0
HBD
29.5
PSA (Ų)
0.43
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Muscarinic acetylcholine receptor M3 antagonist | ANTAGONIST | Muscarinic acetylcholine receptor M3 | ✓ | ✓ |
Indications
Pulmonary Disease, Chronic Obstructive
Activity Summary
IC50 1 meas. best 9.8
Kd 1 meas. best 10.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 10.3 | 10.3 | 0.1 | 1 |
| Muscarinic acetylcholine receptor M3 CHEMBL245 | IC50 | 9.8 | 9.8 | 0.2 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 129.0 | mL.min-1.g-1 | Homo sapiens |
| T1/2 | 10.5 | hr | Cavia porcellus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 0.05012 | nM | 10.3 | Antagonist potency at M3 receptor in Dunkin Hartley guinea pig trachea assessed ... | 22047691 |
| Muscarinic acetylcholine receptor M3 | IC50 | = | 0.1585 | nM | 9.8 | Displacement of [3H]NMS from recombinant human M3 receptor expressed in CHO-K1 c... | 22047691 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22047691 | 10.1016/j.bmcl.2011.10.002 | Cavia porcellus | 4 |
| 22047691 | 10.1016/j.bmcl.2011.10.002 | Unchecked | 2 |
| 22047691 | 10.1016/j.bmcl.2011.10.002 | ADMET | 2 |
| 22047691 | 10.1016/j.bmcl.2011.10.002 | Plasma | 1 |
| 22047691 | 10.1016/j.bmcl.2011.10.002 | Liver microsomes | 1 |
| 22047691 | 10.1016/j.bmcl.2011.10.002 | Muscarinic acetylcholine receptor M3 | 1 |
Data from ChEMBL 36 via Core Engine