Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 6/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | MTOR | P42345 | 9/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7618366 | 0.81 | ADORA2B (0.44) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7620841 | 0.79 | ADORA2B (0.45) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7021179 | 0.78 | PDE5A (0.61) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7617646 | 0.78 | ADORA2A (0.52) | ADORA2BADORA2AADORA1MTORPIK3CA | |
| SCHEMBL7624371 | 0.76 | ADORA2B (0.43) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7624405 | 0.76 | ADORA1 (0.46) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7617552 | 0.76 | ADORA2B (0.52) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7345942 | 0.76 | PDE5A (0.62) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7295604 | 0.76 | ADORA2A (0.59) | ADORA2BADORA2AADORA3ADORA1MTOR | |
| SCHEMBL7295708 | 0.74 | ADORA2A (0.61) | ADORA2BADORA2AADORA3ADORA1MTOR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1030666-A4 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | SMITHKLINE BEECHAM (US) | 2002-10-16 | — | — | EP | disclosed |
| EP-1030666-A1 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | Smithkline Beecham (US) | 2000-08-30 | — | — | EP | disclosed |
| WO-1999020280-A1 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 1999-04-29 | — | — | WO | disclosed |