Compound Detail
CHEMBL1795609
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Basic Information
| ChEMBL ID | CHEMBL1795609 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VDUJLOYKPUKRLR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
303.3
MW (Da)
2.36
ALogP
7
HBA
0
HBD
87.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone acetyltransferase KAT2B CHEMBL5500 | IC50 | 5.74 | 5.605 | 1830.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone acetyltransferase KAT2B | IC50 | = | 1830.0 | nM | 5.74 | Inhibition of histone acetylase activity of human recombinant PCAF expressed in ... | 21353783 |
| Histone acetyltransferase KAT2B | IC50 | = | 3420.0 | nM | 5.47 | Inhibition of histone acetylase activity of human recombinant PCAF expressed in ... | 21353783 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21353783 | 10.1016/j.bmc.2011.01.063 | Histone acetyltransferase KAT2B | 3 |
Data from ChEMBL 36 via Core Engine