Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 10/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | BCR | P11274 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869933 | 0.92 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BHSF1PDE11A | |
| SCHEMBL6874251 | 0.91 | ADORA2A (0.43) | ADORA2AADORA1ADORA2BHSF1PDE11A | |
| SCHEMBL6863200 | 0.88 | ADORA2A (0.38) | ADORA2AADORA1ADORA2BHSF1HPGD | |
| SCHEMBL6871963 | 0.88 | ADORA2A (0.35) | ADORA2AADORA1ADORA2BPDE11AABL1 | |
| SCHEMBL6869532 | 0.87 | ADORA2A (0.36) | ADORA2AADORA1ADORA2BHSF1PDE11A | |
| SCHEMBL6869236 | 0.85 | USP2 (0.38) | ADORA2AF2PDE11A | |
| SCHEMBL6870549 | 0.84 | ADORA2A (0.36) | ADORA2APDE11AHPGDABL1BCR | |
| SCHEMBL6867673 | 0.84 | ADORA2A (0.48) | ADORA2AF2ADORA1ADORA2BHSF1 | |
| SCHEMBL6867675 | 0.83 | ADORA2A (0.33) | ADORA2AADORA1ADORA2B | |
| SCHEMBL6863403 | 0.82 | ADORA2A (0.36) | ADORA2AADORA1ADORA2BHSF1HPGD |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | claimed |