Compound Detail
CHEMBL251603
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL251603 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ICWQOMBLDBHQHC-UHFFFAOYSA-N |
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
330.3
MW (Da)
2.19
ALogP
6
HBA
1
HBD
91.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor CHEMBL1844 | IC50 | 6.41 | 6.13 | 390.0 | 2 |
| HEK293 CHEMBL614818 | IC50 | 4.81 | 4.72 | 15620.0 | 2 |
| Jurkat CHEMBL397 | IC50 | 4.61 | 4.61 | 24830.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 390.0 | nM | 6.41 | Inhibition of ATP-induced autophosphorylation of cFMS tyrosine kinase | 17904845 |
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 1400.0 | nM | 5.85 | Inhibition of ATP-induced autophosphorylation of cFMS tyrosine kinase in HEK 293... | 17904845 |
| HEK293 | IC50 | = | 15620.0 | nM | 4.81 | PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of T-cell specific a... | - |
| HEK293 | IC50 | = | 23600.0 | nM | 4.63 | PUBCHEM_BIOASSAY: SAR analysis of small molecule cytotoxicity in HEK293 cells fo... | - |
| Jurkat | IC50 | = | 24830.0 | nM | 4.61 | PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of T-cell specific a... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17904845 | 10.1016/j.bmcl.2007.09.057 | Macrophage colony-stimulating factor 1 receptor | 2 |
Data from ChEMBL 36 via Core Engine