Compound Detail
CHEMBL5902091
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Basic Information
| ChEMBL ID | CHEMBL5902091 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ROQYSCDOJUQZFY-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
355.4
MW (Da)
2.02
ALogP
6
HBA
1
HBD
71.8
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 4 meas. best 10.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | Kd | 10.07 | 10.07 | 0.1 | 2 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | Kd | 8.43 | 8.43 | 3.7 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | Kd | = | 0.086 | nM | 10.07 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| High affinity nerve growth factor receptor | Kd | = | 0.086 | nM | 10.07 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| Tyrosine-protein kinase JAK2 | Kd | = | 3.7 | nM | 8.43 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| Tyrosine-protein kinase JAK2 | Kd | = | 3.7 | nM | 8.43 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
Data from ChEMBL 36 via Core Engine