Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1847292 | 0.99 | ADORA3 (0.56) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1848428 | 0.91 | ADORA3 (0.65) | ADORA3ADORA2AADORA1NPC1RAB9A | |
| SCHEMBL1850969 | 0.91 | ADORA3 (0.65) | ADORA3ADORA2AADORA1NPC1RAB9A | |
| SCHEMBL1846915 | 0.91 | ADORA3 (0.65) | ADORA3ADORA2AADORA1NPC1RAB9A | |
| SCHEMBL1847852 | 0.90 | ADORA3 (0.59) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1847849 | 0.90 | ADORA3 (0.59) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1850635 | 0.90 | ADORA3 (0.59) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1848849 | 0.90 | ADORA3 (0.59) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1850636 | 0.90 | ADORA3 (0.59) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL1851737 | 0.87 | ADORA3 (0.61) | ADORA3ADORA2AADORA1ALDH1A1NPC1 |
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-2197860-B1 | NEW COMPOUNDS AS ADENOSINE A1 RECEPTOR ANTAGONISTS | PALOBIOFARMA SL (ES) | 2011-05-25 | — | — | EP | claimed |