Compound Detail
CHEMBL229299
CARBOXYNAPHTHOL Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL229299 |
| Name | CARBOXYNAPHTHOL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SJJCQDRGABAVBB-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
188.2
MW (Da)
2.24
ALogP
2
HBA
2
HBD
57.5
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Kd 1 meas. best 3.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L-lactate dehydrogenase A chain CHEMBL4835 | Kd | 3.19 | 3.19 | 640000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L-lactate dehydrogenase A chain | Kd | = | 640000.0 | nM | 3.19 | Binding affinity to 6-His-tagged human LDHA (2 to 322 amino acid residue) expres... | 22417091 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22417091 | 10.1021/jm201734r | L-lactate dehydrogenase A chain | 3 |
| 21778065 | 10.1016/j.bmc.2011.06.080 | No relevant target | 2 |
| 8831754 | 10.1021/jm960229i | Monoclonal antibody (mAb) | 1 |
| 17692525 | 10.1016/j.bmc.2007.07.010 | Tyrosine-protein phosphatase non-receptor type 1 | 1 |
| 21778065 | 10.1016/j.bmc.2011.06.080 | Neuraminidase | 1 |
| 21778065 | 10.1016/j.bmc.2011.06.080 | Influenza A virus | 1 |
| 22417091 | 10.1021/jm201734r | L-lactate dehydrogenase B chain | 1 |
| 22963087 | 10.1021/jm3009844 | MDCK | 1 |
| 22963087 | 10.1021/jm3009844 | Influenza A virus | 1 |
| 22963087 | 10.1021/jm3009844 | Neuraminidase | 1 |
Data from ChEMBL 36 via Core Engine