Compound Detail
CHEMBL4750602
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C[C@@H]1N(C(=O)[C@@H](N)Cc2c[nH]cn2)C[C@@H](CCB(O)O)C[C@]1(N)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL4750602 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BUPVCOHXXPKIMZ-PCVQNBPASA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
367.2
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Arginase-1 CHEMBL1075097 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
| Arginase-2, mitochondrial CHEMBL1795148 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Arginase-1 | IC50 | = | 1.0 | nM | 9.0 | Inhibition of human Arg1 | 32828425 |
| Arginase-2, mitochondrial | IC50 | = | 500.0 | nM | 6.3 | Inhibition of human Arg2 | 32828425 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32828425 | 10.1016/j.bmc.2020.115658 | Arginase-1 | 1 |
| 32828425 | 10.1016/j.bmc.2020.115658 | Arginase-2, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine