Compound Detail
CHEMBL6037990
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Basic Information
| ChEMBL ID | CHEMBL6037990 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QLAIBBCRJCMGRY-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
355.4
MW (Da)
1.94
ALogP
6
HBA
1
HBD
71.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 4 meas. best 6.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase ROS CHEMBL5568 | Kd | 6.39 | 6.39 | 410.0 | 2 |
| ALK tyrosine kinase receptor CHEMBL4247 | Kd | 6.22 | 6.22 | 600.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase ROS | Kd | = | 410.0 | nM | 6.39 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| Proto-oncogene tyrosine-protein kinase ROS | Kd | = | 410.0 | nM | 6.39 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| ALK tyrosine kinase receptor | Kd | = | 600.0 | nM | 6.22 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
| ALK tyrosine kinase receptor | Kd | = | 600.0 | nM | 6.22 | Kinase Binding Assays: Kinase binding assays were performed at DiscoveRx using t... | - |
Data from ChEMBL 36 via Core Engine