Compound Detail
CHEMBL2375627
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Basic Information
| ChEMBL ID | CHEMBL2375627 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UZZVALJVPJZKDU-RUZDIDTESA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
506.5
MW (Da)
6.92
ALogP
5
HBA
2
HBD
62.7
PSA (Ų)
0.22
QED
2
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Methionine aminopeptidase 1 CHEMBL2474 | EC50 | 6.37 | 6.37 | 430.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 6.12 | 6.12 | 760.0 | 1 |
| HeLa CHEMBL399 | EC50 | 6.01 | 6.01 | 970.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Methionine aminopeptidase 1 | EC50 | = | 430.0 | nM | 6.37 | Inhibition of human methionine aminopeptidase 1 in presence of Co2+ | 23634668 |
| NON-PROTEIN TARGET | EC50 | = | 760.0 | nM | 6.12 | Antiproliferative activity against HDFa cells after 30 hrs by [3H]-thymidine inc... | 23634668 |
| HeLa | EC50 | = | 970.0 | nM | 6.01 | Antiproliferative activity against human HeLa cells after 30 hrs by [3H]-thymidi... | 23634668 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23634668 | 10.1021/jm400227z | Methionine aminopeptidase 1 | 7 |
| 23634668 | 10.1021/jm400227z | HUVEC | 2 |
| 23634668 | 10.1021/jm400227z | No relevant target | 1 |
| 23634668 | 10.1021/jm400227z | NON-PROTEIN TARGET | 1 |
| 23634668 | 10.1021/jm400227z | HeLa | 1 |
Data from ChEMBL 36 via Core Engine