Compound Detail
CHEMBL1784725
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Basic Information
| ChEMBL ID | CHEMBL1784725 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CEEHIKQKZBQZLL-UHFFFAOYSA-N |
6
Targets
6
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
277.3
MW (Da)
2.50
ALogP
3
HBA
0
HBD
55.7
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 7.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 7.13 | 7.13 | 74.0 | 1 |
| T-24 CHEMBL614774 | IC50 | 5.54 | 5.54 | 2900.0 | 1 |
| Vascular endothelial growth factor receptor 1 CHEMBL1868 | IC50 | 5.5 | 5.5 | 3200.0 | 1 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 5.34 | 5.34 | 4600.0 | 1 |
| BXPC-3 CHEMBL614530 | IC50 | 5.33 | 5.33 | 4700.0 | 1 |
| WI-38 CHEMBL614391 | IC50 | 5.21 | 5.21 | 6200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 | IC50 | = | 74.0 | nM | 7.13 | Inhibition of FGFR1 using poly(Glu-Tyr)4:1 as substrate after 60 mins by ELISA | 21517068 |
| T-24 | IC50 | = | 2900.0 | nM | 5.54 | Antiproliferative activity against human T24 cells expressing FGFR after 72 hrs ... | 21517068 |
| Vascular endothelial growth factor receptor 1 | IC50 | = | 3200.0 | nM | 5.5 | Inhibition of VEGFR1 using poly(Glu-Tyr)4:1 as substrate measured after 60 mins ... | 21517068 |
| Fibroblast growth factor receptor 3 | IC50 | = | 4600.0 | nM | 5.34 | Inhibition of FGFR3 using poly(Glu-Tyr)4:1 as substrate after 60 mins by ELISA | 21517068 |
| BXPC-3 | IC50 | = | 4700.0 | nM | 5.33 | Antiproliferative activity against human BxPC3 cells expressing FGFR after 72 hr... | 21517068 |
| WI-38 | IC50 | = | 6200.0 | nM | 5.21 | Antiproliferative activity against human WI38 cells expressing FGFR after 72 hrs... | 21517068 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21517068 | 10.1021/jm200258t | Fibroblast growth factor receptor 1 | 4 |
| 21517068 | 10.1021/jm200258t | Receptor tyrosine-protein kinase erbB-2 | 1 |
| 21517068 | 10.1021/jm200258t | BXPC-3 | 1 |
| 21517068 | 10.1021/jm200258t | WI-38 | 1 |
| 21517068 | 10.1021/jm200258t | T-24 | 1 |
| 21517068 | 10.1021/jm200258t | Insulin-like growth factor 1 receptor | 1 |
| 21517068 | 10.1021/jm200258t | Macrophage-stimulating protein receptor | 1 |
| 21517068 | 10.1021/jm200258t | Hepatocyte growth factor receptor | 1 |
| 21517068 | 10.1021/jm200258t | Ephrin type-B receptor 2 | 1 |
| 21517068 | 10.1021/jm200258t | Ephrin type-A receptor 2 | 1 |
| 21517068 | 10.1021/jm200258t | Tyrosine-protein kinase ABL1 | 1 |
| 21517068 | 10.1021/jm200258t | Proto-oncogene tyrosine-protein kinase Src | 1 |
| 21517068 | 10.1021/jm200258t | Proto-oncogene tyrosine-protein kinase receptor Ret | 1 |
| 21517068 | 10.1021/jm200258t | Mast/stem cell growth factor receptor Kit | 1 |
| 21517068 | 10.1021/jm200258t | Platelet-derived growth factor receptor beta | 1 |
| 21517068 | 10.1021/jm200258t | Platelet-derived growth factor receptor alpha | 1 |
| 21517068 | 10.1021/jm200258t | Vascular endothelial growth factor receptor 2 | 1 |
| 21517068 | 10.1021/jm200258t | Vascular endothelial growth factor receptor 1 | 1 |
| 21517068 | 10.1021/jm200258t | Fibroblast growth factor receptor 4 | 1 |
| 21517068 | 10.1021/jm200258t | Fibroblast growth factor receptor 3 | 1 |
Data from ChEMBL 36 via Core Engine