Compound Detail
CHEMBL3646223
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Basic Information
| ChEMBL ID | CHEMBL3646223 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XZPLTNPEACHLGV-UHFFFAOYSA-N |
3
Targets
6
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
314.3
MW (Da)
2.39
ALogP
4
HBA
3
HBD
99.5
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.36
EC50 2 meas. best 4.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Egl nine homolog 1 CHEMBL5697 | IC50 | 6.36 | 6.36 | 440.0 | 4 |
| Vascular endothelial growth factor A, long form CHEMBL1783 | EC50 | 4.82 | 4.82 | 15000.0 | 1 |
| Vascular endothelial growth factor receptor 1 CHEMBL1868 | EC50 | 4.82 | 4.82 | 15000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Egl nine homolog 1 | IC50 | = | 440.0 | nM | 6.36 | Enzyme Assay: The EGLN-1 (or EGLN-3) enzyme activity is determined using mass sp... | - |
| Egl nine homolog 1 | IC50 | = | 440.0 | nM | 6.36 | Mass Spectrometry Assay : The EGLN-1 (or EGLN-3) enzyme activity is determined u... | - |
| Egl nine homolog 1 | IC50 | = | 440.0 | nM | 6.36 | Activity Assay: The EGLN-1 (or EGLN-3) enzyme activity is determined using mass ... | - |
| Egl nine homolog 1 | IC50 | = | 440.0 | nM | 6.36 | EGLN-1 Activity Assay: The EGLN-1 (or EGLN-3) enzyme activity is determined usin... | - |
| Vascular endothelial growth factor A, long form | EC50 | = | 15000.0 | nM | 4.82 | ELISA Assay: HEK293 cells are seeded in 96-well poly-lysine coated plates at 20,... | - |
| Vascular endothelial growth factor receptor 1 | EC50 | = | 15000.0 | nM | 4.82 | VEGF ELISA Assay: HEK293 cells are seeded in 96-well poly-lysine coated plates a... | - |
Data from ChEMBL 36 via Core Engine