Compound Detail
CHEMBL3775692
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Basic Information
| ChEMBL ID | CHEMBL3775692 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LJTKZAIXTKZSBU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
266.3
MW (Da)
1.22
ALogP
4
HBA
1
HBD
68.2
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 4.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone acetyltransferase KAT2B CHEMBL5500 | Kd | 4.68 | 4.68 | 20980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone acetyltransferase KAT2B | Kd | = | 20980.0 | nM | 4.68 | Binding affinity to N-terminal His-tagged PCAF (715 to 831 residues) (unknown or... | 26731131 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26731131 | 10.1021/acs.jmedchem.5b01719 | Histone acetyltransferase KAT2B | 2 |
| 26731131 | 10.1021/acs.jmedchem.5b01719 | Bromodomain-containing protein 9 | 1 |
Data from ChEMBL 36 via Core Engine