Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 3/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.38 |
| ▸ | HTR3B | O95264 | 2/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9656647 | 0.75 | GABRR1 (0.43) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| Maleic Acid SCHEMBL9656644 | 0.75 | GABRR1 (0.43) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7274925 | 0.73 | HTR3E (0.43) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7272916 | 0.73 | HTR3E (0.46) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7297785 | 0.72 | HTR3E (0.42) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7265491 | 0.71 | HTR3E (0.41) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| Fumaric Acid SCHEMBL7323811 | 0.71 | HTR3E (0.44) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| Maleic Acid SCHEMBL9656645 | 0.70 | HTR3E (0.53) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| Fumaric Acid SCHEMBL9668452 | 0.70 | HTR3E (0.53) | GABRR1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL9656120 | 0.65 | MCL1 (0.35) | HTR3AMCL1CYP1A2CYP3A4ADRA2C |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5084474-A | Antagonist of 5-hydroxytryptamine receptors on nerves and useful for treatment of psychotic disorders, anxiety, and nausea and vomiting, compounds of imidazole | GLAXO GROUP LIMITED (GB) | 1992-01-28 | — | — | US | disclosed |