Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CTSC | P53634 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.35 |
| ▸ | HTR3B | O95264 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTR3A | P46098 | 2/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.35 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.35 |
| ▸ | IDH2 | P48735 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23770496 | 0.87 | RAF1 (0.35) | IDH2RAF1BRAF | |
| SCHEMBL23770643 | 0.83 | ADRB2 (0.37) | HTR3EHTR3BALDH1A1HTR3AHTR3D | |
| SCHEMBL23770441 | 0.81 | HTR3E (0.43) | HTR3EHTR3BALDH1A1HTR3AHTR3D | |
| SCHEMBL19968832 | 0.80 | IDH1 (0.37) | CTSLCTSKCTSCHTR3EHTR3B | |
| Hydrochloric Acid SCHEMBL19951419 | 0.80 | IDH1 (0.37) | CTSLCTSKCTSCHTR3EHTR3B | |
| SCHEMBL23770598 | 0.79 | ADRB2 (0.43) | CTSLCTSKCTSCHTR3EHTR3B | |
| SCHEMBL23770833 | 0.78 | ADRB2 (0.39) | HTR3EHTR3BALDH1A1HTR3AHTR3D | |
| SCHEMBL23770454 | 0.73 | PIM1 (0.34) | HTR2CPIM1 | |
| SCHEMBL23770449 | 0.72 | NPC1 (0.33) | — | |
| SCHEMBL23770787 | 0.72 | PDE10A (0.35) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3504194-B1 | N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE | NOVARTIS AG (CH) | 2021-08-18 | — | — | EP | disclosed |