Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 12/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5506104 | 0.89 | ADORA3 (0.44) | ADORA3ADORA1ADORA2AADORA2BCTSL | |
| SCHEMBL5507476 | 0.87 | ADORA2A (0.56) | ADORA3ADORA2AADORA2B | |
| SCHEMBL5506522 | 0.86 | ADORA2A (0.55) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5996922 | 0.86 | ADORA2A (0.55) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5503630 | 0.86 | ADORA2A (0.55) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5503067 | 0.85 | ADORA3 (0.57) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5506216 | 0.84 | ADORA2A (0.52) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5505577 | 0.78 | ADORA1 (0.49) | ADORA3ADORA1ADORA2AADORA2B | |
| SCHEMBL5506065 | 0.77 | ADORA3 (0.44) | ADORA3ADORA1ADORA2AADORA2B | |
| SCHEMBL5502447 | 0.76 | ADORA1 (0.54) | ADORA3ADORA1ADORA2AADORA2B |
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-1537133-B1 | PARTIAL AND FULL AGONISTS OF A1 ADENOSINE RECEPTORS | CV THERAPEUTICS INC (US) | 2007-07-25 | — | — | EP | disclosed |