Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 8/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 6/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.36 |
| ▸ | PI4KA | P42356 | 2/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.35 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | TMIGD3 | P0DMS9 | 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 | |
|---|---|---|---|---|
| SCHEMBL97827 | 0.78 | PIK3CA (0.51) | — | |
| SCHEMBL5162427 | 0.67 | ABCB1 (0.48) | ADORA1ADORA2AADORA2BTLR7PI4KA | |
| SCHEMBL171439 | 0.65 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL5177679 | 0.65 | PI4KA (0.46) | ADORA1ADORA2AADORA2BTLR7PI4KA | |
| SCHEMBL25093187 | 0.64 | TLR7 (0.67) | TLR7 | |
| SCHEMBL3441083 | 0.64 | RXFP1 (0.45) | ADORA1ADORA2AADORA2BTLR7 | |
| SCHEMBL17442995 | 0.62 | HSP90AA1 (0.45) | ADORA1ADORA2AADORA2BTLR7PI4KA | |
| SCHEMBL3441050 | 0.62 | PI4KA (0.49) | ADORA1ADORA2AADORA2BTLR7PI4KA | |
| SCHEMBL5160564 | 0.62 | ABCB1 (0.51) | ADORA1ADORA2AADORA2BADORA3TMIGD3 | |
| SCHEMBL449339 | 0.61 | AKT1 (0.38) | ADORA1ADORA2AADORA2B |
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-2426130-A1 | PURINE DERIVATIVE AND ANTITUMOR AGENT USING SAME | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 2012-03-07 | — | — | EP | disclosed |