Compound Detail
CHEMBL464792
TRANSCROCETIN 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL464792 |
| Name | TRANSCROCETIN |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | PANKHBYNKQNAHN-MQQNZMFNSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
14
Known Names
7
Indications
Molecular Properties
328.4
MW (Da)
4.61
ALogP
2
HBA
2
HBD
74.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
COVID-19 Cytokine Release Syndrome Glioblastoma Glioma Intermittent Claudication Paraganglioma Respiratory Distress Syndrome
Activity Summary
IC50 3 meas. best 5.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 5.22 | 5.22 | 5990.0 | 1 |
| Prostaglandin G/H synthase 1 CHEMBL221 | IC50 | 4.55 | 4.55 | 28000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.43 | 4.43 | 37500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 5990.0 | nM | 5.22 | Inhibition of nitric oxide production in lipopolysaccharide-activated mouse RAW2... | 23305920 |
| Prostaglandin G/H synthase 1 | IC50 | = | 28000.0 | nM | 4.55 | Inhibition of COX1 | 16038536 |
| Unchecked | IC50 | = | 37500.0 | nM | 4.43 | Inhibition of transglutaminase in human keratinocytes in presence of 10 uM retin... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16038536 | 10.1021/np049655u | Prostaglandin G/H synthase 1 | 1 |
| 23305920 | 10.1016/j.bmcl.2012.11.099 | RAW264.7 | 1 |
Data from ChEMBL 36 via Core Engine