Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 2/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20647018 | 0.88 | COMT (0.33) | COMT | |
| SCHEMBL24399797 | 0.72 | COMT (0.33) | COMT | |
| SCHEMBL104766 | 0.70 | COMT (0.32) | COMT | |
| SCHEMBL12812604 | 0.69 | PSEN1 (0.35) | — | |
| SCHEMBL13982880 | 0.69 | LMNA (0.31) | COMT | |
| SCHEMBL21610904 | 0.69 | LMNA (0.31) | COMT | |
| SCHEMBL22624154 | 0.68 | — | — | |
| SCHEMBL13567164 | 0.68 | — | — | |
| SCHEMBL20738506 | 0.67 | LMNA (0.31) | COMT | |
| SCHEMBL9647195 | 0.67 | LMNA (0.34) | COMT |
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-2938344-B1 | PIPERAZINE-SUBSTITUTED [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME (US) | 2017-06-21 | — | — | EP | disclosed |