Compound Detail
CHEMBL1877990
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1877990 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PPALZSWDMRGSQV-UHFFFAOYSA-N |
6
Targets
8
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
306.3
MW (Da)
2.88
ALogP
6
HBA
1
HBD
69.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A CHEMBL2292 | IC50 | 8.15 | 7.775 | 7.0 | 2 |
| Dual specificity protein kinase CLK1 CHEMBL4224 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 1B CHEMBL5543 | IC50 | 7.92 | 7.92 | 12.0 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | IC50 | 7.8 | 7.75 | 16.0 | 2 |
| Dual specificity protein kinase CLK2 CHEMBL4225 | IC50 | 7.22 | 7.22 | 60.0 | 1 |
| Dual specificity protein kinase CLK3 CHEMBL4226 | IC50 | 5.83 | 5.83 | 1473.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A | IC50 | = | 7.0 | nM | 8.15 | Inhibition of DYRK1A (unknown origin) | 23642479 |
| Dual specificity protein kinase CLK1 | IC50 | = | 11.0 | nM | 7.96 | Inhibition of CLK1 (unknown origin) | 23642479 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 1B | IC50 | = | 12.0 | nM | 7.92 | Inhibition of DYRK1B (unknown origin) | 23642479 |
| Dual specificity protein kinase CLK4 | IC50 | = | 16.0 | nM | 7.8 | Inhibition of CLK4 (unknown origin) | 23642479 |
| Dual specificity protein kinase CLK4 | IC50 | = | 20.0 | nM | 7.7 | Inhibition of CLK4 (unknown origin) by bioluminescence assay | 23642479 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A | IC50 | = | 40.0 | nM | 7.4 | Inhibition of DYRK1A (unknown origin) by bioluminescence assay | 23642479 |
| Dual specificity protein kinase CLK2 | IC50 | = | 60.0 | nM | 7.22 | Inhibition of CLK2 (unknown origin) | 23642479 |
| Dual specificity protein kinase CLK3 | IC50 | = | 1473.0 | nM | 5.83 | Inhibition of CLK3 (unknown origin) | 23642479 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A | 2 |
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity protein kinase CLK4 | 2 |
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity protein kinase CLK3 | 1 |
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity protein kinase CLK2 | 1 |
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity tyrosine-phosphorylation-regulated kinase 1B | 1 |
| 23642479 | 10.1016/j.bmcl.2013.02.096 | Dual specificity protein kinase CLK1 | 1 |
Data from ChEMBL 36 via Core Engine