Compound Detail
CHEMBL5204926
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 | CHEMBL5204926 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KAOHZVCVDBIQAP-CYBMUJFWSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
451.4
MW (Da)
3.76
ALogP
7
HBA
2
HBD
93.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 11 CHEMBL3864 | IC50 | 8.68 | 8.68 | 2.1 | 1 |
| SW1463 CHEMBL1075589 | IC50 | 6.23 | 6.23 | 590.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 11 | IC50 | = | 2.1 | nM | 8.68 | Inhibition of N-terminal 6His-tagged full-length H2N-VE(pY)LDLDLD(PEG8)RVD(pY)VV... | 33582386 |
| SW1463 | IC50 | = | 590.0 | nM | 6.23 | Cytotoxicity against human SW1463 cells assessed as inhibition of cell growth in... | 33582386 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33582386 | 10.1016/j.ejmech.2021.113264 | Tyrosine-protein phosphatase non-receptor type 11 | 2 |
| 33582386 | 10.1016/j.ejmech.2021.113264 | SW1463 | 1 |
Data from ChEMBL 36 via Core Engine