Compound Detail
CHEMBL1951290
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 | CHEMBL1951290 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VRGIRQGXJQIDQS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
461.4
MW (Da)
5.36
ALogP
5
HBA
1
HBD
76.9
PSA (Ų)
0.44
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycylpeptide N-tetradecanoyltransferase CHEMBL3988596 | IC50 | 4.57 | 4.57 | 26900.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.31 | 4.31 | 49000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycylpeptide N-tetradecanoyltransferase | IC50 | = | 26900.0 | nM | 4.57 | Enzyme Inhibition Assay: Measurements were performed using a modification of the... | - |
| Unchecked | IC50 | = | 49000.0 | nM | 4.31 | Inhibition of Trypanosoma brucei N-myristoyltransferase using [3H]myristoyl-CoA ... | 22148754 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22148754 | 10.1021/jm201091t | Unchecked | 1 |
| 22148754 | 10.1021/jm201091t | Glycylpeptide N-tetradecanoyltransferase 1 | 1 |
| 22148754 | 10.1021/jm201091t | Trypanosoma brucei | 1 |
Data from ChEMBL 36 via Core Engine