Compound Detail
CHEMBL4870693
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Basic Information
| ChEMBL ID | CHEMBL4870693 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HWXBTNAVRSUOJR-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
148.1
MW (Da)
-0.70
ALogP
3
HBA
3
HBD
94.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Kd 1 meas. best 5.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Methylcytosine dioxygenase TET2 CHEMBL4523344 | Kd | 5.47 | 5.47 | 3420.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Methylcytosine dioxygenase TET2 | Kd | = | 3420.0 | nM | 5.47 | Binding affinity to human recombinant TET2 (1099 to 1936) catalytic domain asses... | 33894507 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33894507 | 10.1016/j.bmc.2021.116141 | Methylcytosine dioxygenase TET2 | 2 |
Data from ChEMBL 36 via Core Engine