Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2542700 | 0.83 | ADORA1 (0.49) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL4636230 | 0.80 | ADORA1 (0.48) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL2538400 | 0.80 | ADORA1 (0.54) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL4636244 | 0.80 | ADORA2B (0.49) | ADORA3ADORA2BMAOBADORA2AGLA | |
| SCHEMBL4636557 | 0.78 | ADORA2B (0.46) | ADORA3ADORA2BADORA1ADORA2A | |
| SCHEMBL4637278 | 0.78 | ADORA2B (0.49) | ADORA3ADORA2BMAOBADORA2AGLA | |
| SCHEMBL2536377 | 0.74 | ADORA2B (0.40) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL12233446 | 0.73 | ADORA3 (0.35) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL4781188 | 0.72 | ADORA2B (0.45) | ADORA3ADORA2BADORA1MAOBADORA2A | |
| SCHEMBL2546553 | 0.72 | ADORA2B (0.47) | ADORA3ADORA2BADORA2AGLABLM |
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-1939197-A1 | 8-ethinylxanthine derivatives as selective A2A receptor antagonists | SCHWARZ PHARMA AG (DE) | 2008-07-02 | — | — | EP | disclosed |