Compound Detail
CHEMBL3086319
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Basic Information
| ChEMBL ID | CHEMBL3086319 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NWYBAXOGMLBAQR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
421.6
MW (Da)
3.94
ALogP
5
HBA
4
HBD
113.8
PSA (Ų)
0.54
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor CHEMBL5570 | IC50 | 8.11 | 8.1 | 7.8 | 2 |
| Mast/stem cell growth factor receptor Kit CHEMBL1936 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 7.8 | nM | 8.11 | Inhibition of FMS in mouse BMDM cells | 24138939 |
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 8.1 | nM | 8.09 | Inhibition of c-fms in mouse bone marrow macrophages assessed as reduction in re... | - |
| Mast/stem cell growth factor receptor Kit | IC50 | = | 250.0 | nM | 6.6 | Inhibition of KIT in human Mo7e cells assessed as inhibition of SCF-dependent ce... | 24138939 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24138939 | 10.1016/j.bmcl.2013.09.061 | Macrophage colony-stimulating factor 1 receptor | 2 |
| 24138939 | 10.1016/j.bmcl.2013.09.061 | Liver microsome | 1 |
| 24138939 | 10.1016/j.bmcl.2013.09.061 | Unchecked | 1 |
| 24138939 | 10.1016/j.bmcl.2013.09.061 | Mast/stem cell growth factor receptor Kit | 1 |
Data from ChEMBL 36 via Core Engine