Compound Detail
CHEMBL405584
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CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL405584 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | UKJYWRYJTVYJRZ-ISULXFBGSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1691.0
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 8.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neurotensin receptor type 1 CHEMBL4123 | Kd | 8.89 | 8.815 | 1.3 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neurotensin receptor type 1 | Kd | = | 1.3 | nM | 8.89 | In vitro inhibition of [3H]NT binding to porcine striatal Neurotensin receptor 1 | 15481995 |
| Neurotensin receptor type 1 | Kd | = | 1.8 | nM | 8.74 | In vitro inhibition of [3H]-NT binding to human striatal Neurotensin receptor 1 | 15481995 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15481995 | 10.1021/jm049644y | Neurotensin receptor type 1 | 2 |
Data from ChEMBL 36 via Core Engine