Compound Detail
CHEMBL5083349
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 | CHEMBL5083349 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KGTZSYZMWFDDLO-UHFFFAOYSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
388.4
MW (Da)
4.15
ALogP
4
HBA
3
HBD
64.2
PSA (Ų)
0.49
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 6.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 6.57 | 6.57 | 268.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.96 | 5.6767 | 1100.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 | IC50 | = | 268.0 | nM | 6.57 | Inhibition of FGFR1 (unknown origin) (458 to 765 residues) transfected in Escher... | 34780700 |
| Unchecked | IC50 | = | 1100.0 | nM | 5.96 | Cytotoxicity against human SUM52 cells assessed as reduction in cell viability i... | 34780700 |
| Unchecked | IC50 | = | 2600.0 | nM | 5.58 | Cytotoxicity against human VM-CUB-3 cells assessed as reduction in cell viabilit... | 34780700 |
| Unchecked | IC50 | = | 3250.0 | nM | 5.49 | Cytotoxicity against human JMSU-1 cells assessed as reduction in cell viability ... | 34780700 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34780700 | 10.1021/acs.jmedchem.1c01163 | Unchecked | 4 |
| 34780700 | 10.1021/acs.jmedchem.1c01163 | Fibroblast growth factor receptor 2 | 1 |
| 34780700 | 10.1021/acs.jmedchem.1c01163 | Fibroblast growth factor receptor 1 | 1 |
| 34780700 | 10.1021/acs.jmedchem.1c01163 | Fibroblast growth factor receptor 3 | 1 |
Data from ChEMBL 36 via Core Engine