Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.79 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2550785 | 1.00 | ADORA2A (0.79) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2555841 | 0.89 | ADORA2A (1.00) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2555844 | 0.89 | ADORA2A (1.00) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2557074 | 0.86 | ADORA2A (0.63) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2557077 | 0.86 | ADORA2A (0.63) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2554298 | 0.78 | ADORA2A (0.65) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2554296 | 0.78 | ADORA2A (0.65) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL27904499 | 0.76 | ADORA2A (0.76) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL27887643 | 0.76 | ADORA2A (0.76) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2555106 | 0.76 | ADORA2A (0.76) | ADORA2AADORA3ADORA2BADORA1PDE10A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2552909-A1 | 4 - AMINOPYRIMIDINE DERIVATIVES AND THEIR AS AS ADENOSINE A2A RECEPTOR ANTAGONISTS | Palobiofarma, S.L. (ES) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011121418-A1 | 4 - AMINOPYRIMIDINE DERIVATIVES AND THEIR AS AS ADENOSINE A2A RECEPTOR ANTAGONISTS | PALOBIOFARMA, S.L. (ES) | 2011-10-06 | — | — | WO | disclosed |