Compound Detail
CHEMBL3817944
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CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C
Basic Information
| ChEMBL ID | CHEMBL3817944 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | ANBOSJQKVCTUFN-SDTDYBAESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1849.2
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium channel subfamily K member 2 CHEMBL2321615 | IC50 | 7.15 | 7.15 | 71.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium channel subfamily K member 2 | IC50 | = | 71.0 | nM | 7.15 | Inhibition of of TREK1 (unknown origin) expressed in whole COS7 cells assessed a... | 26588045 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26588045 | 10.1021/acs.jmedchem.5b00671 | Potassium channel subfamily K member 2 | 1 |
Data from ChEMBL 36 via Core Engine