Compound Detail
CHEMBL5090566
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Basic Information
| ChEMBL ID | CHEMBL5090566 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OYKIIJTXTXJYKZ-UHFFFAOYSA-N |
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
370.5
MW (Da)
4.01
ALogP
4
HBA
3
HBD
64.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 6.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 6.41 | 6.41 | 389.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.16 | 5.8467 | 700.0 | 3 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 4.54 | 4.54 | 29000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 | IC50 | = | 389.0 | nM | 6.41 | Inhibition of FGFR1 (unknown origin) (458 to 765 residues) transfected in Escher... | 34780700 |
| Unchecked | IC50 | = | 700.0 | nM | 6.16 | Cytotoxicity against human SUM52 cells assessed as reduction in cell viability i... | 34780700 |
| Unchecked | IC50 | = | 2000.0 | nM | 5.7 | Cytotoxicity against human VM-CUB-3 cells assessed as reduction in cell viabilit... | 34780700 |
| Unchecked | IC50 | = | 2100.0 | nM | 5.68 | Cytotoxicity against human JMSU-1 cells assessed as reduction in cell viability ... | 34780700 |
| Fibroblast growth factor receptor 2 | IC50 | = | 29000.0 | nM | 4.54 | Inhibition of wild type FGFR2 (unknown origin) (461 to 763 residues) transfected... | 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