Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 12/20 | 0.42 |
| ▸ | RORC | P51449 | 5/20 | 0.42 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4708052 | 0.93 | IDH1 (0.41) | RORBRORCIDH1GABRA2GABRB2 | |
| SCHEMBL4707462 | 0.92 | RORB (0.41) | RORBRORCIDH1CDC7GRM2 | |
| SCHEMBL4705407 | 0.92 | RORB (0.42) | RORBRORCCDC7TACR1GABRA2 | |
| Water SCHEMBL4707272 | 0.91 | RORB (0.41) | RORBRORCCDC7TACR1GABRA2 | |
| Water SCHEMBL4707271 | 0.91 | RORB (0.41) | RORBRORCCDC7TACR1GABRA2 | |
| SCHEMBL4706766 | 0.91 | RORB (0.43) | RORBRORCIDH1CDC7GRM2 | |
| SCHEMBL4708323 | 0.89 | RORB (0.38) | RORBRORCIDH1TACR1GABRA2 | |
| SCHEMBL4705482 | 0.88 | RORB (0.41) | RORBRORCIDH1GRM2TACR1 | |
| SCHEMBL6385997 | 0.87 | RORB (0.42) | RORBRORCIDH1CDC7GRM2 | |
| SCHEMBL4708328 | 0.86 | RORB (0.41) | RORBRORCCDC7TACR1 |
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 |