Compound Detail
CHEMBL463241
MORACIN D Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL463241 |
| Name | MORACIN D |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CHAAQDMHLLQJRO-UHFFFAOYSA-N |
4
Targets
5
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
308.3
MW (Da)
4.70
ALogP
4
HBA
2
HBD
62.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 5.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.59 | 5.59 | 2540.0 | 1 |
| Xanthine dehydrogenase/oxidase CHEMBL1929 | IC50 | 5.29 | 5.29 | 5100.0 | 1 |
| Tyrosinase CHEMBL3318 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
| RAW264.7 CHEMBL612557 | IC50 | 4.75 | 4.75 | 18000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2540.0 | nM | 5.59 | Inhibition of alpha-glucosidase (unknown origin) | 25461329 |
| Xanthine dehydrogenase/oxidase | IC50 | = | 5100.0 | nM | 5.29 | Inhibition of XOD (unknown origin) using xanthine as substrate preincubated for ... | 37625387 |
| Tyrosinase | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of mushroom tyrosinase | 25461329 |
| RAW264.7 | IC50 | = | 18000.0 | nM | 4.75 | Antiinflammatory activity against mouse RAW264.7 cells assessed as reduction of ... | 25461329 |
| RAW264.7 | IC50 | = | 18000.0 | nM | 4.75 | Antiinflammatory activity against mouse RAW264.7 cells assessed as reduction of ... | 25461329 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Molecular identity unknown | 6 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | RAW264.7 | 2 |
| 37625387 | 10.1021/acs.jnatprod.3c00099 | Xanthine dehydrogenase/oxidase | 2 |
| 11678652 | 10.1021/np010288l | Aromatase | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Klebsiella pneumoniae | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Escherichia coli | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Pseudomonas aeruginosa | 1 |
| 25461329 | 10.1016/j.ejmech.2014.11.047 | Rosellinia necatrix | 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