Compound Detail
CHEMBL2349310
AZD-8797 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL2349310 |
| Name | AZD-8797 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | ZMQSLMZOWVGBSM-GXTWGEPZSA-N |
4
Targets
5
Activities
2
Assay Types
5
PK Parameters
20
Publications
4
Known Names
1
Indications
Molecular Properties
403.6
MW (Da)
4.34
ALogP
8
HBA
3
HBD
97.0
PSA (Ų)
0.38
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Indications
Severe Acute Respiratory Syndrome
Activity Summary
Ki 3 meas. best 8.41
IC50 2 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CX3C chemokine receptor 1 CHEMBL4843 | Ki | 8.41 | 8.41 | 3.9 | 1 |
| Adenosine receptor A1 CHEMBL226 | Ki | 6.88 | 6.88 | 132.0 | 1 |
| Rattus norvegicus CHEMBL376 | IC50 | 5.82 | 5.82 | 1500.0 | 2 |
| C-X-C chemokine receptor type 2 CHEMBL2434 | Ki | 5.55 | 5.55 | 2800.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 13.0 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 34.0 | mL.min-1.g-1 | Homo sapiens |
| F | 39.0 | % | Rattus norvegicus |
| T1/2 | 2.7 | hr | Rattus norvegicus |
| T1/2 | 1.9 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CX3C chemokine receptor 1 | Ki | = | 3.9 | nM | 8.41 | Displacement of [125I]-CX3CL1 from human CX3CR1 transfected in HEK293 cells afte... | 23516963 |
| Adenosine receptor A1 | Ki | = | 132.0 | nM | 6.88 | Binding affinity to adenosine A1 receptor (unknown origin) | 23516963 |
| Rattus norvegicus | IC50 | = | 1500.0 | nM | 5.82 | Reduction in demyelination in sc dosed experimental autoimmune encephalomyelitis... | 23516963 |
| Rattus norvegicus | IC50 | = | 1500.0 | nM | 5.82 | Reduction in spinal cord neuroinflammation in sc dosed experimental autoimmune e... | 23516963 |
| C-X-C chemokine receptor type 2 | Ki | = | 2800.0 | nM | 5.55 | Displacement of [125I]-IL8 from human CXCR2 transfected in HEK293 cells after 4 ... | 23516963 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL5724801 | Fibroblast | 304 |
| - | 10.6019/CHEMBL5058577 | Fibroblast | 304 |
| - | 10.6019/CHEMBL5724801 | U2OS | 304 |
| - | 10.6019/CHEMBL5058577 | U2OS | 304 |
| - | 10.6019/CHEMBL5724801 | HEK-293T | 304 |
| - | 10.6019/CHEMBL5058577 | HEK-293T | 304 |
| - | 10.6019/CHEMBL4689842 | Fibroblast | 10 |
| - | 10.6019/CHEMBL4689842 | HEK-293T | 10 |
| 23516963 | 10.1021/jm3012273 | Rattus norvegicus | 9 |
| 23516963 | 10.1021/jm3012273 | Unchecked | 9 |
| - | 10.6019/CHEMBL4689842 | U2OS | 8 |
| - | 10.6019/CHEMBL5058564 | U2OS | 5 |
| - | 10.6019/CHEMBL5058564 | Fibroblast | 5 |
| - | 10.6019/CHEMBL5058564 | HEK-293T | 4 |
| 23516963 | 10.1021/jm3012273 | CX3C chemokine receptor 1 | 3 |
| - | 10.6019/CHEMBL5060014 | Aurora kinase A | 2 |
| - | 10.6019/CHEMBL5060014 | Cyclin-dependent kinase 2 | 2 |
| - | 10.6019/CHEMBL5060014 | Bromodomain-containing protein 4 | 2 |
| - | 10.6019/CHEMBL5060014 | Tyrosine-protein kinase ABL1 | 2 |
| - | 10.6019/CHEMBL5060014 | Peregrin | 2 |
Data from ChEMBL 36 via Core Engine