Compound Detail
CHEMBL2326021
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Basic Information
| ChEMBL ID | CHEMBL2326021 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MCQPMCDEXWCMDM-CYBMUJFWSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
2.98
ALogP
5
HBA
2
HBD
69.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C theta type CHEMBL3920 | Ki | 8.05 | 8.05 | 9.0 | 1 |
| Protein kinase C delta type CHEMBL2996 | Ki | 6.1 | 6.1 | 792.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C theta type | Ki | = | 9.0 | nM | 8.05 | Inhibition of full-length recombinant PKC theta (unknown origin) using ERMRPRKRQ... | 23398373 |
| Protein kinase C delta type | Ki | = | 792.0 | nM | 6.1 | Inhibition of PKC delta (unknown origin) using ERMRPRKRQGSVRRRV as substrate aft... | 23398373 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23398373 | 10.1021/jm301465a | Unchecked | 1 |
| 23398373 | 10.1021/jm301465a | Protein kinase C delta type | 1 |
| 23398373 | 10.1021/jm301465a | Protein kinase C theta type | 1 |
Data from ChEMBL 36 via Core Engine