Compound Detail
CHEMBL221026
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 | CHEMBL221026 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NOMODOYJJNGELG-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
308.3
MW (Da)
2.88
ALogP
4
HBA
2
HBD
71.5
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.21
IC50 1 meas. best 5.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HEK293 CHEMBL614818 | EC50 | 6.21 | 6.21 | 620.0 | 1 |
| Egl nine homolog 1 CHEMBL5697 | IC50 | 5.34 | 5.34 | 4600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HEK293 | EC50 | = | 620.0 | nM | 6.21 | Induction of VEGF in HEK293 cells by ELISA | 16931007 |
| Egl nine homolog 1 | IC50 | = | 4600.0 | nM | 5.34 | Inhibition of human EGLN1 | 16931007 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16931007 | 10.1016/j.bmcl.2006.08.040 | Egl nine homolog 1 | 1 |
| 16931007 | 10.1016/j.bmcl.2006.08.040 | HEK293 | 1 |
Data from ChEMBL 36 via Core Engine