Compound Detail
CHEMBL4783117
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 | CHEMBL4783117 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MIDJWYNEFWHVMQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
382.4
MW (Da)
3.74
ALogP
6
HBA
1
HBD
71.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Methionine aminopeptidase 1 CHEMBL2474 | IC50 | 4.96 | 4.96 | 10940.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.58 | 4.58 | 26440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Methionine aminopeptidase 1 | IC50 | = | 10940.0 | nM | 4.96 | Inhibition of human MetAP1 expressed in Escherichia coli BL21 (DE3) using L-meth... | 31759728 |
| Unchecked | IC50 | = | 26440.0 | nM | 4.58 | Inhibition of Leishmania donovani MetAP1 expressed in Escherichia coli BL21 (DE3... | 31759728 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31759728 | 10.1016/j.ejmech.2019.111860 | Methionine aminopeptidase 1 | 1 |
| 31759728 | 10.1016/j.ejmech.2019.111860 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine