Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | SDHB | P21912 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29464851 | 0.77 | HSD11B1 (0.40) | CYP1A2CYP3A4ARTRPA1HSD11B1 | |
| SCHEMBL19968788 | 0.77 | HSD11B1 (0.40) | CYP1A2CYP3A4ARTRPA1HSD11B1 | |
| SCHEMBL19968786 | 0.77 | BACE1 (0.44) | ARALDH1A1TRPA1HSD11B1HTT | |
| SCHEMBL23770551 | 0.75 | PTPN1 (0.36) | CYP1A2CYP3A4ARCYP2C19ALDH1A1 | |
| SCHEMBL23770815 | 0.74 | CYP1A2 (0.39) | CYP1A2CYP3A4ARCYP2C19ALDH1A1 | |
| SCHEMBL23770399 | 0.74 | PTPN1 (0.35) | CYP1A2CYP3A4ARCYP2C19ALDH1A1 | |
| SCHEMBL19927705 | 0.73 | SCN1A (0.38) | CYP1A2CYP3A4CYP2C19ALDH1A1HSD11B1 | |
| SCHEMBL29464874 | 0.73 | SCN1A (0.38) | CYP1A2CYP3A4CYP2C19ALDH1A1HSD11B1 | |
| SCHEMBL19951335 | 0.72 | SYK (0.42) | CYP1A2CYP3A4CYP2C19ALDH1A1HSD11B1 | |
| SCHEMBL19925735 | 0.72 | PTGS2 (0.35) | CYP1A2CYP3A4CYP2C19ALDH1A1HSD11B1 |
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 |