Compound Detail
CHEMBL4129367
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 | CHEMBL4129367 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZADHSJIAOKUORX-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
418.5
MW (Da)
4.74
ALogP
3
HBA
1
HBD
72.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein mono-ADP-ribosyltransferase PARP10 CHEMBL2429708 | IC50 | 5.78 | 5.78 | 1650.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein mono-ADP-ribosyltransferase PARP10 | IC50 | = | 1659.59 | nM | 5.78 | Inhibition of full length recombinant His6-tagged human PARP10 expressed in Esch... | 29748053 |
| Protein mono-ADP-ribosyltransferase PARP10 | IC50 | = | 1650.0 | nM | 5.78 | Inhibition of full length recombinant His6-tagged human PARP10 expressed in Esch... | 29748053 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29748053 | 10.1016/j.bmcl.2018.04.056 | Protein mono-ADP-ribosyltransferase PARP10 | 2 |
| 29748053 | 10.1016/j.bmcl.2018.04.056 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine