Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.39 |
| ▸ | GALR2 | O43603 | 2/20 | 0.38 |
| ▸ | GALR1 | P47211 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
| ▸ | ITGAL | P20701 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23770765 | 0.92 | S1PR1 (0.35) | S1PR1LRRK2GALR2GALR1ALDH1A1 | |
| SCHEMBL23770452 | 0.86 | PDE10A (0.34) | S1PR1GALR2GALR1KDM4EMAPT | |
| SCHEMBL23770466 | 0.82 | CYP1A2 (0.37) | ALDH1A1KDM4ECDK2 | |
| SCHEMBL23770770 | 0.81 | ADRB2 (0.38) | ALDH1A1 | |
| SCHEMBL23770671 | 0.80 | GALR2 (0.39) | GALR2GALR1ALDH1A1HPGDKDM4E | |
| SCHEMBL23770739 | 0.79 | CNR2 (0.38) | GALR2GALR1MAPK1 | |
| SCHEMBL23770632 | 0.79 | ADRB2 (0.42) | ALDH1A1 | |
| SCHEMBL23770433 | 0.79 | PDE10A (0.36) | GALR2GALR1ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL23770694 | 0.79 | GALR2 (0.40) | GALR2GALR1ALDH1A1KDM4E | |
| SCHEMBL23770664 | 0.78 | NPY5R (0.36) | GALR2GALR1ALDH1A1HPGDKDM4E |
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 |