Compound Detail
CHEMBL3040731
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NCCN(CCNC(=O)c1ccc(C(=O)NCCOCCOCCNC(=O)/N=C(/N)NCCC[C@@H](NC(=O)C(c2ccccc2)c2ccccc2)C(=O)NCc2ccc(O)cc2)cc1)CCNC(=O)c1ccc(C(=O)NCCOCCOCCNC(=O)/N=C(/N)NCCC[C@@H](NC(=O)C(c2ccccc2)c2ccccc2)C(=O)NCc2ccc(O)cc2)cc1
Basic Information
| ChEMBL ID | CHEMBL3040731 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LWSIXIMCXWLGDB-UVHVAMGRSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1702.0
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide Y receptor type 4 CHEMBL4877 | Ki | 6.82 | 6.4 | 150.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide Y receptor type 4 | Ki | = | 150.0 | nM | 6.82 | Displacement of [3H](2R,7R)-10 from human NPY Y4 receptor expressed in CHO cells... | 27223253 |
| Neuropeptide Y receptor type 4 | Ki | = | 630.0 | nM | 6.2 | Displacement of [3H]18 from human NPY Y4 receptor expressed in CHO cells co-expr... | 27223253 |
| Neuropeptide Y receptor type 4 | Ki | = | 660.0 | nM | 6.18 | Displacement of [3H](2R,7R)-10 from human NPY Y4 receptor expressed in CHO cells... | 27223253 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27223253 | 10.1021/acs.jmedchem.6b00309 | Neuropeptide Y receptor type 4 | 3 |
Data from ChEMBL 36 via Core Engine