Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 9/20 | 0.38 |
| ▸ | RORC | P51449 | 5/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 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 | |
|---|---|---|---|---|
| SCHEMBL4708052 | 0.89 | IDH1 (0.41) | RORBRORCCYP3A4IDH1CYP2D6 | |
| SCHEMBL4708632 | 0.89 | RORB (0.42) | RORBRORCIDH1TACR1GABRA2 | |
| SCHEMBL4707462 | 0.88 | RORB (0.41) | RORBRORCIDH1 | |
| SCHEMBL4706074 | 0.88 | RORB (0.39) | RORBRORCP2RX7USP2MEN1 | |
| SCHEMBL4705407 | 0.88 | RORB (0.42) | RORBRORCTACR1GABRA2GABRB2 | |
| Water SCHEMBL4707272 | 0.88 | RORB (0.41) | RORBRORCTACR1GABRA2GABRB2 | |
| Water SCHEMBL4707271 | 0.88 | RORB (0.41) | RORBRORCTACR1GABRA2GABRB2 | |
| SCHEMBL4706528 | 0.85 | RORB (0.36) | RORBRORCP2RX7USP2MEN1 | |
| SCHEMBL4708328 | 0.85 | RORB (0.41) | RORBRORCHTTHSD17B10TACR1 | |
| SCHEMBL4709807 | 0.84 | RORB (0.40) | RORBRORCP2RX7TACR1GPBAR1 |
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 |