Compound Detail
CHEMBL4650350
INZOMELID Phase I
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Phase I
Basic Information
| ChEMBL ID | CHEMBL4650350 |
| Name | INZOMELID |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | MTOUOUSKXWSTAX-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
6
Known Names
1
Indications
Molecular Properties
388.5
MW (Da)
2.95
ALogP
5
HBA
2
HBD
93.1
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Parkinson Disease
Activity Summary
IC50 3 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NACHT, LRR and PYD domains-containing protein 3 CHEMBL3779755 | IC50 | 7.85 | 7.825 | 14.0 | 2 |
| NACHT, LRR and PYD domains-containing protein 3 CHEMBL1741208 | IC50 | 7.4 | 7.4 | 39.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NACHT, LRR and PYD domains-containing protein 3 | IC50 | = | 14.0 | nM | 7.85 | Inhibition of NLRP3 inflammasome activation in LPS/ATP-induced C57BL/6 mouse BMD... | 38751194 |
| NACHT, LRR and PYD domains-containing protein 3 | IC50 | = | 16.0 | nM | 7.8 | Inhibition of NLRP3 in mouse BMDMs assessed as reduction in LPS/ATP-induced IL-1... | 37639823 |
| NACHT, LRR and PYD domains-containing protein 3 | IC50 | = | 39.5 | nM | 7.4 | Inhibition of NLRP3 inflammasome activation in LPS-activated human THP-1 cells a... | 38686671 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38751194 | 10.1021/acs.jmedchem.4c00504 | NACHT, LRR and PYD domains-containing protein 3 | 2 |
| 38686671 | 10.1021/acs.jmedchem.4c00357 | NACHT, LRR and PYD domains-containing protein 3 | 2 |
| 37639823 | 10.1016/j.ejmech.2023.115750 | NACHT, LRR and PYD domains-containing protein 3 | 1 |
Data from ChEMBL 36 via Core Engine