Compound Detail
CHEMBL2370408
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CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)CC
Basic Information
| ChEMBL ID | CHEMBL2370408 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | MASXKPLGZRMBJF-MVSGICTGSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1478.9
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HL-60 CHEMBL383 | EC50 | 5.5 | 5.5 | 3162.3 | 1 |
| Mas-related G-protein coupled receptor member X2 CHEMBL5849 | EC50 | 4.93 | 4.93 | 11749.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | EC50 | = | 3162.28 | nM | 5.5 | -log of the half-maximal concentration for stimulation of GTPase in HL-60 membra... | 9301677 |
| Mas-related G-protein coupled receptor member X2 | EC50 | = | 11748.98 | nM | 4.93 | Agonist activity at N-terminal Flag-tagged human MRGPRX2 receptor expressed in t... | 28288109 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28288109 | 10.1038/nchembio.2334 | Mas-related G-protein coupled receptor member X2 | 3 |
| 9301677 | 10.1021/jm9703092 | HL-60 | 2 |
Data from ChEMBL 36 via Core Engine