Compound Detail
CHEMBL1392315
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Basic Information
| ChEMBL ID | CHEMBL1392315 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NDBAIHGDDWYLGY-UHFFFAOYSA-N |
7
Targets
9
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
360.5
MW (Da)
2.84
ALogP
5
HBA
0
HBD
59.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 6.31
EC50 1 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphoethanolamine/phosphocholine phosphatase CHEMBL6113 | IC50 | 6.31 | 6.31 | 489.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.89 | 5.89 | 1295.0 | 1 |
| Histone acetyltransferase KAT2B CHEMBL5500 | IC50 | 5.21 | 5.21 | 6190.0 | 1 |
| Histone acetyltransferase KAT2A CHEMBL5501 | IC50 | 5.2 | 5.2 | 6270.0 | 1 |
| Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase CHEMBL1741212 | IC50 | 5.16 | 4.7167 | 6880.0 | 3 |
| Histone acetyltransferase p300 CHEMBL3784 | IC50 | 5.09 | 5.09 | 8030.0 | 1 |
| Glucose-6-phosphate 1-dehydrogenase CHEMBL5347 | IC50 | 4.51 | 4.51 | 30700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00245H | Histone acetyltransferase KAT2B | 2 |
| - | 10.1039/C4MD00245H | Histone acetyltransferase KAT2A | 2 |
| - | 10.1039/C4MD00245H | Histone acetyltransferase p300 | 2 |
Data from ChEMBL 36 via Core Engine