Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | GALR2 | O43603 | 1/20 | 0.33 |
| ▸ | GALR1 | P47211 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 2/20 | 0.31 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.31 |
| ▸ | RAF1 | P04049 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23770826 | 0.92 | S1PR1 (0.41) | S1PR1MAPK1GALR2GALR1TP53 | |
| SCHEMBL29464476 | 0.83 | NR3C1 (0.37) | S1PR1GALR2GALR1TP53NR3C1 | |
| SCHEMBL19925790 | 0.83 | NR3C1 (0.37) | S1PR1GALR2GALR1TP53NR3C1 | |
| SCHEMBL23770593 | 0.82 | GALR2 (0.33) | GALR2GALR1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL23770466 | 0.81 | CYP1A2 (0.37) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL23770452 | 0.80 | PDE10A (0.34) | S1PR1GALR2GALR1TP53 | |
| SCHEMBL23770770 | 0.78 | ADRB2 (0.38) | ALDH1A1CYP1A2CYP2C19RAF1BRAF | |
| SCHEMBL23770877 | 0.76 | RBP4 (0.35) | TP53ALDH1A1CYP1A2CYP2C19RAF1 | |
| SCHEMBL23770632 | 0.75 | ADRB2 (0.42) | ALDH1A1CYP1A2CYP2C19WDR5 | |
| SCHEMBL23770671 | 0.74 | GALR2 (0.39) | GALR2GALR1ALDH1A1CYP1A2CYP3A4 |
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 |