Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 13/20 | 0.82 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.82 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.77 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.77 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.71 |
| ▸ | HTR2C | P28335 | 6/20 | 0.66 |
| ▸ | HTR2B | P41595 | 6/20 | 0.66 |
| ▸ | TSPO | P30536 | 1/20 | 0.64 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.64 |
| ▸ | HRH1 | P35367 | 1/20 | 0.63 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.59 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.56 |
| ▸ | ADK | P55263 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5816711 | 1.00 | ADORA3 (0.82) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL12269658 | 0.88 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL12269990 | 0.87 | ADORA3 (1.00) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL19464937 | 0.87 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL5807801 | 0.87 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL2363334 | 0.87 | ADORA3 (1.00) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL19459458 | 0.87 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL21710876 | 0.87 | ADORA3 (1.00) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL22933437 | 0.87 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A | |
| SCHEMBL19464938 | 0.87 | ADORA3 (0.77) | ADORA3ADORA1HSP90AA1HSP90B1ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006091905-A1 | BICYCLO (3.1.0) HEXANE DERIVATIVES AS ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2006-08-31 | — | — | WO | disclosed |