Compound Detail
CHEMBL3686883
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
CNC(=O)n1ccc2cc(Oc3ccnc(NC(=O)c4ccc(C5CCN(C)CC5)cc4)c3)c(OCCOC)cc21
Basic Information
| ChEMBL ID | CHEMBL3686883 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PVPYYKGOLJMILD-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
557.6
MW (Da)
5.10
ALogP
8
HBA
2
HBD
107.0
PSA (Ų)
0.28
QED
2
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor 2 CHEMBL3107 | IC50 | 8.29 | 8.29 | 5.1 | 1 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.24 | 8.24 | 5.7 | 1 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.22 | 8.22 | 6.0 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 6.17 | 6.17 | 683.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor 2 | IC50 | = | 5.1 | nM | 8.29 | ADP-Glo Kinase Assay: In this assay, the inhibitory activity of a test substance... | - |
| Fibroblast growth factor receptor 1 | IC50 | = | 5.7 | nM | 8.24 | ADP-Glo Kinase Assay: In this assay, the inhibitory activity of a test substance... | - |
| Fibroblast growth factor receptor 3 | IC50 | = | 6.0 | nM | 8.22 | ADP-Glo Kinase Assay: In this assay, the inhibitory activity of a test substance... | - |
| Fibroblast growth factor receptor 4 | IC50 | = | 683.3 | nM | 6.17 | ADP-Glo Kinase Assay: In this assay, the inhibitory activity of a test substance... | - |
Data from ChEMBL 36 via Core Engine