Compound Detail
CHEMBL420624
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Basic Information
| ChEMBL ID | CHEMBL420624 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GHVBIROTJQDRQB-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
315.2
MW (Da)
3.72
ALogP
4
HBA
2
HBD
63.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 10.0 | 10.0 | 0.1 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 0.1 | nM | 10.0 | Inhibition of phosphorylation of polyglutamic acid/tyrosine random copolymer by ... | 9397172 |
| Epidermal growth factor receptor | IC50 | = | 0.1 | nM | 10.0 | Inhibition of Epidermal growth factor receptor from A431 cells | 7658435 |
| Epidermal growth factor receptor | IC50 | = | 0.1 | nM | 10.0 | Concentration required to inhibit the phosphorylation of a 14-residue fragment o... | 8568816 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9397172 | 10.1021/jm970366v | Epidermal growth factor receptor | 1 |
| 7658435 | 10.1021/jm00018a008 | Epidermal growth factor receptor | 1 |
| 8568816 | 10.1021/jm9503613 | Epidermal growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine