Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.62 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.62 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.62 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.62 |
| ▸ | TYMP | P19971 | 1/20 | 0.54 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | NPY1R | P25929 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NPY2R | P49146 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7732648 | 1.00 | ADORA3 (0.62) | ADORA3ADORA1ADORA2AADORA2BTYMP | |
| SCHEMBL6669865 | 0.89 | ADORA3 (0.79) | ADORA3ADORA1ADORA2AADORA2BTYMP | |
| SCHEMBL6669862 | 0.89 | ADORA3 (0.79) | ADORA3ADORA1ADORA2AADORA2BTYMP | |
| SCHEMBL7064426 | 0.86 | ADORA3 (0.63) | ADORA3ADORA1DNPH1LMNAALDH1A1 | |
| SCHEMBL7064432 | 0.86 | ADORA3 (0.63) | ADORA3ADORA1DNPH1LMNAALDH1A1 | |
| SCHEMBL7064170 | 0.85 | ADORA1 (0.71) | ADORA3ADORA1ADORA2AADORA2BDNPH1 | |
| SCHEMBL7064173 | 0.85 | ADORA1 (0.71) | ADORA3ADORA1ADORA2AADORA2BDNPH1 | |
| SCHEMBL6260861 | 0.80 | ADORA3 (0.57) | ADORA3ADORA1ADORA2AADORA2BLMNA | |
| SCHEMBL7732691 | 0.80 | TYMP (0.76) | ADORA3ADORA1ADORA2AADORA2BTYMP | |
| SCHEMBL5364283 | 0.80 | DOT1L (0.59) | ADORA3ADORA1TYMP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6407076-B1 | ANTIISCHEMIC, ANTILIPOLYTIC, ANTICONVULSANT AND HYPOTENSIVE AGENTS; CARDIOVASCULAR AND NERVOUS SYSTEM DISORDERS; ATHEROSCLEROSIS | SMITHKLINE BEECHAM CORPORATION | 2002-06-18 | — | — | US | disclosed |
| EP-1027363-A2 | ADENOSINE A1-RECEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 2000-08-16 | — | — | EP | disclosed |
| WO-1999024450-A2 | ADENSINE A1 RECEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 1999-05-20 | — | — | WO | disclosed |