Compound Detail
CHEMBL5834923
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Basic Information
| ChEMBL ID | CHEMBL5834923 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MGCBQJWHAMOVKQ-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
378.4
MW (Da)
2.97
ALogP
6
HBA
2
HBD
81.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase JAK1 CHEMBL2835 | IC50 | 8.28 | 8.28 | 5.3 | 1 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | IC50 | 8.05 | 8.05 | 8.9 | 1 |
| Tyrosine-protein kinase JAK3 CHEMBL2148 | IC50 | 7.63 | 7.63 | 23.4 | 1 |
| Non-receptor tyrosine-protein kinase TYK2 CHEMBL3553 | IC50 | 7.35 | 7.35 | 45.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase JAK1 | IC50 | = | 5.28 | nM | 8.28 | JAK Inhibition Activity Assays: Reagents used in JAK inhibition assay: Base Reac... | - |
| Tyrosine-protein kinase JAK2 | IC50 | = | 8.91 | nM | 8.05 | JAK Inhibition Activity Assays: Reagents used in JAK inhibition assay: Base Reac... | - |
| Tyrosine-protein kinase JAK3 | IC50 | = | 23.4 | nM | 7.63 | JAK Inhibition Activity Assays: Reagents used in JAK inhibition assay: Base Reac... | - |
| Non-receptor tyrosine-protein kinase TYK2 | IC50 | = | 45.1 | nM | 7.35 | JAK Inhibition Activity Assays: Reagents used in JAK inhibition assay: Base Reac... | - |
Data from ChEMBL 36 via Core Engine