Compound Detail
CHEMBL483633
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 | CHEMBL483633 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XJKWXDPKDNEEKV-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
266.2
MW (Da)
3.19
ALogP
4
HBA
0
HBD
48.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Poly [ADP-ribose] polymerase tankyrase-1 CHEMBL6164 | IC50 | 6.44 | 6.44 | 360.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Poly [ADP-ribose] polymerase tankyrase-1 | IC50 | = | 363.08 | nM | 6.44 | Inhibition of human TNKS1 (1030 to 1317) using NAD+ as substrate by fluorescence... | 24116873 |
| Poly [ADP-ribose] polymerase tankyrase-1 | IC50 | = | 360.0 | nM | 6.44 | Inhibition of human TNKS1 (1030 to 1317) using NAD+ as substrate by fluorescence... | 24116873 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30594450 | 10.1016/j.bmc.2018.12.021 | Unchecked | 5 |
| 24116873 | 10.1021/jm401463y | Poly [ADP-ribose] polymerase tankyrase-1 | 2 |
| 27343852 | 10.1016/j.ejmech.2016.06.024 | NON-PROTEIN TARGET | 2 |
| 27343852 | 10.1016/j.ejmech.2016.06.024 | DNA topoisomerase 2-alpha | 2 |
| 469554 | 10.1021/np50001a002 | L1210 | 1 |
Data from ChEMBL 36 via Core Engine