Compound Detail
CHEMBL3262619
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Basic Information
| ChEMBL ID | CHEMBL3262619 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SYCNFZSLURHSBO-CYBMUJFWSA-N |
4
Targets
6
Activities
1
Assay Types
1
PK Parameters
7
Publications
0
Known Names
Molecular Properties
375.4
MW (Da)
2.71
ALogP
6
HBA
5
HBD
110.5
PSA (Ų)
0.38
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 6.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK CHEMBL2599 | IC50 | 6.78 | 6.3 | 165.0 | 3 |
| Tyrosine-protein kinase Lyn CHEMBL3905 | IC50 | 6.5 | 6.5 | 315.0 | 1 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | IC50 | 6.02 | 6.02 | 950.0 | 1 |
| Tyrosine-protein kinase ZAP-70 CHEMBL2803 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| t1/2 | - | - | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase SYK | IC50 | = | 165.0 | nM | 6.78 | Inhibition of Syk (unknown origin) using 4 uM peptide assessed as product format... | 24726806 |
| Tyrosine-protein kinase Lyn | IC50 | = | 315.0 | nM | 6.5 | Inhibition of Lyn (unknown origin) | 24726806 |
| Tyrosine-protein kinase SYK | IC50 | = | 378.0 | nM | 6.42 | Inhibition of Syk in anti IgM-stimulated human Ramos cells assessed as BLNK phos... | 24726806 |
| Tyrosine-protein kinase JAK2 | IC50 | = | 950.0 | nM | 6.02 | Inhibition of JAK2 (unknown origin) | 24726806 |
| Tyrosine-protein kinase SYK | IC50 | = | 1994.0 | nM | 5.7 | Inhibition of Syk in human whole blood assessed as inhibition of P-SLP76 in CD14... | 24726806 |
| Tyrosine-protein kinase ZAP-70 | IC50 | = | 3000.0 | nM | 5.52 | Inhibition of ZAP70 (unknown origin) | 24726806 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Tyrosine-protein kinase SYK | 3 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Tyrosine-protein kinase Lyn | 1 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Tyrosine-protein kinase ZAP-70 | 1 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Tyrosine-protein kinase JAK2 | 1 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Bone marrow cell | 1 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
| 24726806 | 10.1016/j.bmcl.2014.03.075 | Liver microsome | 1 |
Data from ChEMBL 36 via Core Engine