Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 18/20 | 0.58 |
| ▸ | ADORA1 | P30542 | 13/20 | 0.58 |
| ▸ | ADORA2B | P29275 | 9/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | GMNN | O75496 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL22757412 | 0.86 | ADORA3 (0.51) | ADORA3ADORA1ADORA2BADORA2A | |
| SCHEMBL22750530 | 0.85 | ADORA3 (0.58) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22757494 | 0.85 | ADORA3 (0.58) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22750491 | 0.82 | ADORA3 (0.60) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22757413 | 0.81 | ADORA3 (0.38) | ADORA3ADORA1ADORA2BADORA2A | |
| SCHEMBL22750542 | 0.80 | ADORA3 (0.57) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22757401 | 0.79 | ADORA3 (0.60) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22750483 | 0.79 | ADORA3 (0.60) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22757316 | 0.77 | ADORA3 (0.69) | ADORA3ADORA1ADORA2BADORA2AMAPK1 | |
| SCHEMBL22757399 | 0.77 | ADORA3 (0.69) | ADORA3ADORA1ADORA2BADORA2AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020247546-A1 | ADENOSINE ANALOGS FOR THE TREATMENT OF DISEASE | BIOINTERVENE, INC. (US) | 2020-12-10 | — | — | WO | disclosed |