Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 13/20 | 0.62 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL7344952 | 0.85 | ADORA2A (0.77) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL8124748 | 0.83 | ADORA2A (0.85) | ADORA2AADORA1HPGD | |
| SCHEMBL7333945 | 0.80 | ADORA2A (0.71) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL7346016 | 0.78 | ADORA2A (0.90) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL4759580 | 0.78 | ADORA2A (0.76) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL12972222 | 0.77 | ADORA2A (0.77) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL7343382 | 0.76 | ADORA2A (0.75) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL13904673 | 0.76 | ADORA2A (0.76) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL13853059 | 0.76 | ADORA2A (0.76) | ADORA2AADORA1KDM4ENPC1ALDH1A1 | |
| SCHEMBL7339226 | 0.75 | ADORA2A (1.00) | ADORA2AADORA1KDM4ENPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5935964-A | 1,2,4-triazolo 1,5-c! pyrimidine heterocyclic analogues having antagonistic activity on adenosine A2a receptor | SCHERING CORPORATION (US) | 1999-08-10 | — | — | US | disclosed |