Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 16/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 16/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 15/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.46 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.46 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4062627 | 0.83 | ADORA3 (0.55) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4069308 | 0.83 | ADORA3 (0.60) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4066247 | 0.81 | ADORA3 (0.57) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4067321 | 0.81 | ADORA3 (0.57) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL783764 | 0.80 | ADORA3 (0.68) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL6666123 | 0.79 | PIK3CD (0.51) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4058506 | 0.78 | ADORA3 (0.59) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL6659013 | 0.78 | ADORA3 (0.48) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL6663728 | 0.77 | ADORA3 (0.48) | ADORA3ADORA1ADORA2AADORA2BPI4KA | |
| SCHEMBL4064370 | 0.76 | ADORA1 (0.60) | ADORA3ADORA1ADORA2AADORA2BPI4KA |
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-1444982-A1 | The use of purine derivatives as selective kinase inhibitors | MERCKLE GMBH (DE) | 2004-08-11 | — | — | EP | disclosed |