Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 5/20 | 0.38 |
| ▸ | ICAM1 | P05362 | 5/20 | 0.38 |
| ▸ | ITGAL | P20701 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MPL | P40238 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23770583 | 0.86 | RAF1 (0.36) | ITGB2ICAM1ITGALMPLSOS1 | |
| SCHEMBL19951424 | 0.80 | SCN9A (0.38) | ITGB2ICAM1ITGALCYP1A2CYP2C19 | |
| SCHEMBL29464379 | 0.80 | SCN9A (0.38) | ITGB2ICAM1ITGALCYP1A2CYP2C19 | |
| SCHEMBL23770753 | 0.76 | GRIN2B (0.36) | MPLSOS1CLK2LRRK2PRKCA | |
| SCHEMBL23770570 | 0.76 | KRAS (0.33) | LRRK2 | |
| SCHEMBL23770607 | 0.75 | JAK2 (0.35) | LRRK2 | |
| SCHEMBL19968862 | 0.74 | SCN9A (0.37) | ITGB2ICAM1ITGALMPLCLK2 | |
| SCHEMBL23770822 | 0.74 | MPL (0.33) | ALDH1A1MPLCLK2LRRK2PRKCA | |
| SCHEMBL23770810 | 0.73 | MPL (0.32) | MPLPRKCAPRKCQPDE10A | |
| SCHEMBL23770677 | 0.73 | ABL1 (0.36) | — |
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 |