Compound Detail
CHEMBL408356
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL408356 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | BMXJNWVYNYOAHC-KMOVSZGYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1822.1
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 9.85
Ki 1 meas. best 10.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nociceptin receptor CHEMBL2014 | Ki | 10.1 | 10.1 | 0.1 | 1 |
| Nociceptin receptor CHEMBL2014 | EC50 | 9.85 | 9.85 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nociceptin receptor | Ki | = | 0.08 | nM | 10.1 | Affinity for human Opioid receptor like 1 (ORL-1) expressed in HEK293 cells | 12431054 |
| Nociceptin receptor | EC50 | = | 0.14 | nM | 9.85 | Affinity for human Opioid receptor like 1 (ORL-1) expressed in HEK293 cells | 12431054 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12431054 | 10.1021/jm0202021 | Nociceptin receptor | 3 |
Data from ChEMBL 36 via Core Engine