Compound Detail
CHEMBL3301609
TOREFORANT 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL3301609 |
| Name | TOREFORANT |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | FCRFVPZAXGJLPW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
2
Known Names
1
Indications
1
Mechanisms
Molecular Properties
392.6
MW (Da)
4.48
ALogP
5
HBA
2
HBD
69.7
PSA (Ų)
0.61
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Histamine H4 receptor antagonist | ANTAGONIST | Histamine H4 receptor | ✓ | ✓ |
Indications
Arthritis, Rheumatoid
Activity Summary
Ki 2 meas. best 8.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 8.08 | 8.02 | 8.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 8.4 | nM | 8.08 | Binding affinity to histamine H4 receptor (unknown origin) assessed as inhibitio... | 36731273 |
| Histamine H4 receptor | Ki | = | 11.0 | nM | 7.96 | Displacement of [3H]-histamine from recombinant human histamine H4 receptor expr... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 4 |
| - | 10.6019/CHEMBL4651402 | Vero C1008 | 2 |
| 36731273 | 10.1016/j.ejmech.2023.115151 | Histamine H4 receptor | 1 |
Data from ChEMBL 36 via Core Engine