Compound Detail
CHEMBL2309599
GALNON Enter ChEMBL ID:
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Cc1cc(=O)oc2cc(NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC3CCCCC3)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12
Basic Information
| ChEMBL ID | CHEMBL2309599 |
| Name | GALNON |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IKNOZZKXIDSTRN-GPOMZPHUSA-N |
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
678.8
MW (Da)
6.53
ALogP
7
HBA
4
HBD
152.8
PSA (Ų)
0.09
QED
2
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 4.92
Ki 2 meas. best 4.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Galanin receptor type 1 CHEMBL4894 | Ki | 4.93 | 4.93 | 11700.0 | 1 |
| Galanin receptor type 1 CHEMBL4894 | Kd | 4.92 | 4.92 | 12000.0 | 1 |
| Galanin receptor type 2 CHEMBL3176 | Kd | 4.62 | 4.62 | 24000.0 | 1 |
| Galanin receptor type 2 CHEMBL5577 | Ki | 4.47 | 4.47 | 34100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Galanin receptor type 1 | Ki | = | 11700.0 | nM | 4.93 | Binding affinity to human GalR1 | 20121116 |
| Galanin receptor type 1 | Kd | = | 12000.0 | nM | 4.92 | Binding affinity to human GalR1 | 19053761 |
| Galanin receptor type 2 | Kd | = | 24000.0 | nM | 4.62 | Binding affinity to human GalR2 | 19053761 |
| Galanin receptor type 2 | Ki | = | 34100.0 | nM | 4.47 | Binding affinity to rat GalR2 | 20121116 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19053761 | 10.1021/jm801088x | Galanin receptor type 3 | 1 |
| 19053761 | 10.1021/jm801088x | Galanin receptor type 2 | 1 |
| 19053761 | 10.1021/jm801088x | Galanin receptor type 1 | 1 |
| 20121116 | 10.1021/jm9018349 | Galanin receptor type 1 | 1 |
| 20121116 | 10.1021/jm9018349 | Galanin receptor type 2 | 1 |
Data from ChEMBL 36 via Core Engine