Compound Detail
CHEMBL5560296
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Basic Information
| ChEMBL ID | CHEMBL5560296 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSXTUEZRGJAGSO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
309.3
MW (Da)
2.28
ALogP
4
HBA
2
HBD
84.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nicotinamide phosphoribosyltransferase CHEMBL1744525 | IC50 | 5.16 | 5.16 | 6872.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nicotinamide phosphoribosyltransferase | IC50 | = | 6872.0 | nM | 5.16 | Inhibition of N-terminal GST-tagged human recombinant NAMPT (2 to 491 residues) ... | 38224650 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38224650 | 10.1016/j.ejmech.2024.116127 | Histone deacetylase 1 | 1 |
| 38224650 | 10.1016/j.ejmech.2024.116127 | Histone deacetylase 2 | 1 |
| 38224650 | 10.1016/j.ejmech.2024.116127 | Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) | 1 |
| 38224650 | 10.1016/j.ejmech.2024.116127 | Nicotinamide phosphoribosyltransferase | 1 |
| 38224650 | 10.1016/j.ejmech.2024.116127 | MV4-11 | 1 |
Data from ChEMBL 36 via Core Engine