Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.56 |
| ▸ | MAOB | P27338 | 3/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2548492 | 0.92 | ADORA1 (0.57) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL4635978 | 0.89 | ADORA1 (0.55) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL2537627 | 0.88 | ADORA1 (0.57) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL4950417 | 0.88 | ADORA1 (0.53) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL4947786 | 0.88 | ADORA1 (0.53) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL4725744 | 0.88 | ADORA1 (0.53) | ADORA1MAOBADORA2AADORA2B | |
| SCHEMBL4636251 | 0.87 | ADORA1 (0.53) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL4636568 | 0.86 | ADORA1 (0.52) | ADORA1MAOBADORA2AADORA3SMN1; SMN2 | |
| SCHEMBL16199476 | 0.84 | ADORA1 (0.56) | ADORA1MAOBADORA2AADORA3ADORA2B | |
| SCHEMBL4636591 | 0.84 | ADORA1 (0.54) | ADORA1MAOBADORA2AADORA3ADORA2B |
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-1939197-A1 | 8-ethinylxanthine derivatives as selective A2A receptor antagonists | SCHWARZ PHARMA AG (DE) | 2008-07-02 | — | — | EP | disclosed |