Compound Detail
CHEMBL1290110
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 | CHEMBL1290110 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WUBVIVKBXNEORA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
366.5
MW (Da)
4.98
ALogP
4
HBA
0
HBD
56.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zn finger protein CHEMBL1293200 | Ki | 4.11 | 4.11 | 77700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zn finger protein | Ki | = | 77700.0 | nM | 4.11 | Inhibition of human recombinant CA12 catalytic domain by stopped-flow CO2 hydrat... | 21067924 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21067924 | 10.1016/j.bmcl.2010.10.094 | Zn finger protein | 1 |
| 21067924 | 10.1016/j.bmcl.2010.10.094 | Carbonic anhydrase 1 | 1 |
| 21067924 | 10.1016/j.bmcl.2010.10.094 | Carbonic anhydrase 2 | 1 |
| 21067924 | 10.1016/j.bmcl.2010.10.094 | Carbonic anhydrase 9 | 1 |
Data from ChEMBL 36 via Core Engine