Compound Detail
CHEMBL572102
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Basic Information
| ChEMBL ID | CHEMBL572102 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KURQUYFXRUVCIU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
379.5
MW (Da)
3.34
ALogP
5
HBA
2
HBD
66.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-arginine methyltransferase CARM1 CHEMBL5406 | IC50 | 9.08 | 9.08 | 0.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-arginine methyltransferase CARM1 | IC50 | = | 0.84 | nM | 9.08 | Inhibition of human CARM1 assessed as inhibition of histone3 methylation | 19632837 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19632837 | 10.1016/j.bmcl.2009.07.040 | Histone-arginine methyltransferase CARM1 | 1 |
Data from ChEMBL 36 via Core Engine