Compound Detail
CHEMBL457519
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 | CHEMBL457519 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DVIGASXUWCPKAT-CABCVRRESA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
395.5
MW (Da)
2.26
ALogP
8
HBA
4
HBD
132.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK CHEMBL2599 | IC50 | 7.04 | 7.04 | 92.0 | 1 |
| Tyrosine-protein kinase ZAP-70 CHEMBL2803 | IC50 | 5.39 | 5.39 | 4100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK | IC50 | = | 92.0 | nM | 7.04 | Inhibition of human Syk expressed in Sf9 cells | 18823784 |
| Tyrosine-protein kinase ZAP-70 | IC50 | = | 4100.0 | nM | 5.39 | Inhibition of human ZAP70 expressed in Sf9 cells | 18823784 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18823784 | 10.1016/j.bmc.2008.09.015 | Tyrosine-protein kinase SYK | 1 |
| 18823784 | 10.1016/j.bmc.2008.09.015 | Tyrosine-protein kinase ZAP-70 | 1 |
Data from ChEMBL 36 via Core Engine