Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 9/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.58 |
| ▸ | ACHE | P22303 | 2/20 | 0.58 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.58 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.58 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.58 |
| ▸ | MC3R | P41968 | 1/20 | 0.58 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.58 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.58 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.58 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.58 |
| ▸ | PDE4A | P27815 | 4/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.50 |
| ▸ | BLM | P54132 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9295135 | 0.87 | ADORA2B (0.52) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL8952269 | 0.85 | ADORA2B (0.51) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL8072026 | 0.85 | ADORA2B (0.51) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL8076046 | 0.85 | ADORA2B (0.51) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL28359735 | 0.84 | ADORA2B (0.63) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL29884015 | 0.80 | ADORA2B (0.67) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL23974961 | 0.79 | ADORA2B (0.65) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL6773717 | 0.78 | ADORA2B (0.46) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL6773714 | 0.78 | ADORA2B (0.46) | ADORA2BADORA2AACHEPIK3CDPOLB | |
| SCHEMBL8072025 | 0.75 | ADORA2B (0.62) | ADORA2BADORA2AACHEPDE4APDE4B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57085387-A | — | — | None | — | — | JP | disclosed |
| JP-S5785387-A | PREPARATION OF 1-(-5'-OXOHEXYL)-3,7-DIMETHYLXANTHINE | TEIKOKU CHEM IND CORP LTD | 1982-05-28 | — | — | JP | disclosed |