Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 10/20 | 0.49 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869952 | 0.87 | ADORA2A (0.52) | ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL6869841 | 0.82 | ADORA2A (0.48) | ADORA2ATSPOKDM4EALDH1A1HPGD | |
| SCHEMBL6863381 | 0.80 | ADORA2A (0.46) | ADORA2ATSPOKDM4EALDH1A1HPGD | |
| SCHEMBL6867557 | 0.79 | ADORA2A (0.46) | ADORA2AHPGD | |
| SCHEMBL6867481 | 0.78 | ADORA2A (0.51) | ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL6870143 | 0.74 | ADORA2A (0.65) | ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL6867472 | 0.73 | ADORA2A (0.40) | ADORA2A | |
| SCHEMBL6869437 | 0.72 | KMT2A (0.47) | ADORA2AALDH1A1 | |
| SCHEMBL6867645 | 0.72 | POLB (0.49) | KDM4EALDH1A1HPGDROCK2HSD17B10 | |
| SCHEMBL6863761 | 0.71 | HPGD (0.46) | KDM4EALDH1A1HPGDROCK2ROCK1 |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |