Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 9/20 | 0.41 |
| ▸ | RORC | P51449 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4708209 | 0.95 | RORB (0.39) | RORBRORCCDC7ADORA3GRM2 | |
| SCHEMBL4705371 | 0.93 | IDH1 (0.43) | RORBRORCGAAGRM2 | |
| SCHEMBL4707133 | 0.92 | RORB (0.40) | RORBRORCGRM2 | |
| SCHEMBL4707172 | 0.90 | RORB (0.46) | RORBRORCALDH1A1GAATSHR | |
| SCHEMBL4705502 | 0.88 | RORB (0.39) | RORBRORCGAAPTGER4GRM2 | |
| SCHEMBL4757295 | 0.87 | RORB (0.51) | RORBRORCALDH1A1GAATSHR | |
| SCHEMBL4708690 | 0.87 | RORB (0.40) | RORBRORCALDH1A1GAATSHR | |
| SCHEMBL4706528 | 0.87 | RORB (0.36) | RORBRORCGRM2 | |
| SCHEMBL4705450 | 0.85 | RORB (0.42) | RORBRORCALDH1A1GAATSHR | |
| Tradipitant SCHEMBL2898629 | 0.85 | RORB (0.42) | RORBRORCCDC7GRM2 |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |