Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.59 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5034070 | 0.99 | ADORA3 (0.58) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5034544 | 0.92 | ADORA1 (0.61) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5032082 | 0.90 | ADORA3 (0.56) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5040388 | 0.86 | ADORA3 (0.54) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5032111 | 0.85 | ADORA3 (0.56) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| SCHEMBL5040344 | 0.85 | ADORA3 (0.59) | ADORA3ADORA1ADORA2AADORA2BSLC29A1 | |
| SCHEMBL465954 | 0.85 | ADORA2A (0.56) | ADORA3ADORA1ADORA2AADORA2BHIF1A | |
| SCHEMBL5040384 | 0.84 | ADORA1 (0.61) | ADORA3ADORA1ADORA2AADORA2BSLC29A1 | |
| SCHEMBL5034102 | 0.84 | ADORA3 (0.63) | ADORA3ADORA1ADORA2AADORA2BMEN1 | |
| Water SCHEMBL3630434 | 0.84 | ADORA2A (0.55) | ADORA3ADORA1ADORA2AADORA2BHIF1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1881991-A1 | A1 ADENOSINE RECEPTOR AGONISTS | CV THERAPEUTICS, INC. (US) | 2008-01-30 | — | — | EP | claimed |
| WO-2006125211-A1 | A1 ADENOSINE RECEPTOR AGONISTS | CV THERAPEUTICS, INC. (US) | 2006-11-23 | — | — | WO | claimed |
| EP-1881991-A1 | A1 ADENOSINE RECEPTOR AGONISTS | CV THERAPEUTICS, INC. (US) | 2008-01-30 | — | — | EP | disclosed |
| WO-2006125211-A1 | A1 ADENOSINE RECEPTOR AGONISTS | CV THERAPEUTICS, INC. (US) | 2006-11-23 | — | — | WO | disclosed |