Compound Detail
CHEMBL465881
MORACIN N Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL465881 |
| Name | MORACIN N |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WBSCSIABHGPAMC-UHFFFAOYSA-N |
4
Targets
5
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
310.4
MW (Da)
4.73
ALogP
4
HBA
3
HBD
73.8
PSA (Ų)
0.61
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 6.03 | 6.03 | 924.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.56 | 5.56 | 2760.0 | 1 |
| Pancreatic triacylglycerol lipase CHEMBL1687677 | IC50 | 4.53 | 4.53 | 29700.0 | 1 |
| Aromatase CHEMBL1978 | IC50 | 4.51 | 4.51 | 31100.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 924.0 | nM | 6.03 | Inhibition of mushroom tyrosinase | 25461329 |
| Unchecked | IC50 | = | 2760.0 | nM | 5.56 | Inhibition of alpha-glucosidase (unknown origin) | 25461329 |
| Pancreatic triacylglycerol lipase | IC50 | = | 29700.0 | nM | 4.53 | Inhibition of porcine pancreatic lipase using p-nitrophenylbutyrate as substrate... | 25935644 |
| Aromatase | IC50 | = | 31100.0 | nM | 4.51 | Inhibition of aromatase from human placental microsomes | 11678652 |
| Aromatase | IC50 | = | 31100.0 | nM | 4.51 | Inhibition of human aromatase in term placenta microsome assessed as radioactivi... | 25461329 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25461329 | 10.1016/j.ejmech.2014.11.047 | NON-PROTEIN TARGET | 4 |
| 25935644 | 10.1016/j.bmcl.2015.04.045 | Pancreatic triacylglycerol lipase | 2 |
| 11678652 | 10.1021/np010288l | Aromatase | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Escherichia coli | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Klebsiella pneumoniae | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Pseudomonas aeruginosa | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | A549 | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | A2780 | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Aromatase | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Unchecked | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine