Compound Detail
CHEMBL210547
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Basic Information
| ChEMBL ID | CHEMBL210547 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YQMGTUAKPTUCGH-REZTVBANSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
390.5
MW (Da)
3.47
ALogP
6
HBA
2
HBD
93.1
PSA (Ų)
0.52
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C delta type CHEMBL2996 | Ki | 6.01 | 5.39 | 980.0 | 2 |
| Protein kinase C alpha type CHEMBL299 | Ki | 5.62 | 5.62 | 2400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C delta type | Ki | = | 980.0 | nM | 6.01 | Binding affinity to PKCdeltaC1b in presence of phospholipid | 16722637 |
| Protein kinase C alpha type | Ki | = | 2400.0 | nM | 5.62 | Displacement of [20-3H]PDBU from recombinant PKCalpha in presence of phosphatidy... | 16722637 |
| Protein kinase C delta type | Ki | = | 16900.0 | nM | 4.77 | Binding affinity to PKCdeltaC1b in absence of phospholipid | 16722637 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16722637 | 10.1021/jm060011o | Protein kinase C delta type | 3 |
| 16722637 | 10.1021/jm060011o | Protein kinase C alpha type | 1 |
Data from ChEMBL 36 via Core Engine