Compound Detail
CHEMBL31141
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Basic Information
| ChEMBL ID | CHEMBL31141 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DXGHHFSCXULIMU-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
336.4
MW (Da)
3.48
ALogP
5
HBA
1
HBD
64.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK CHEMBL2599 | IC50 | 6.8 | 6.8 | 160.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK | IC50 | = | 160.0 | nM | 6.8 | Inhibitory activity against spleen tyrosine kinase (SYK) | 12668002 |
| Tyrosine-protein kinase SYK | IC50 | = | 160.0 | nM | 6.8 | Inhibition of recombinant Syk | 19254842 |
| Tyrosine-protein kinase SYK | IC50 | = | 160.0 | nM | 6.8 | Inhibition of SYK | 22257213 |
| Tyrosine-protein kinase SYK | IC50 | = | 160.0 | nM | 6.8 | Inhibition of spleen tyrosine kinase (unknown origin) | 23917087 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12668002 | 10.1016/s0960-894x(03)00163-x | Tyrosine-protein kinase SYK | 1 |
| 19254842 | 10.1016/j.bmcl.2009.02.049 | Tyrosine-protein kinase SYK | 1 |
| 22257213 | 10.1021/jm201271b | Tyrosine-protein kinase SYK | 1 |
| 23917087 | 10.1016/j.ejmech.2013.04.070 | Tyrosine-protein kinase SYK | 1 |
Data from ChEMBL 36 via Core Engine