Compound Detail
CHEMBL4292485
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 | CHEMBL4292485 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PNWIPCZSMBTBRL-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
278.3
MW (Da)
1.99
ALogP
6
HBA
1
HBD
59.3
PSA (Ų)
0.93
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Intestinal-type alkaline phosphatase CHEMBL5573 | IC50 | 6.51 | 6.51 | 310.0 | 1 |
| Alkaline phosphatase, tissue-nonspecific isozyme CHEMBL5979 | IC50 | 5.84 | 5.84 | 1440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Intestinal-type alkaline phosphatase | IC50 | = | 310.0 | nM | 6.51 | Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins fol... | 29268128 |
| Alkaline phosphatase, tissue-nonspecific isozyme | IC50 | = | 1440.0 | nM | 5.84 | Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins fo... | 29268128 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29268128 | 10.1016/j.ejmech.2017.11.068 | Alkaline phosphatase, tissue-nonspecific isozyme | 1 |
| 29268128 | 10.1016/j.ejmech.2017.11.068 | Intestinal-type alkaline phosphatase | 1 |
Data from ChEMBL 36 via Core Engine