Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4430543 | 1.00 | EP300 (0.39) | EP300P2RX7TRPV1TRPV3CYP3A4 | |
| SCHEMBL4441783 | 0.92 | P2RX7 (0.38) | EP300P2RX7TRPV1TRPV3CYP2C9 | |
| SCHEMBL4436024 | 0.92 | P2RX7 (0.44) | EP300P2RX7TRPV1 | |
| SCHEMBL4435812 | 0.92 | P2RX7 (0.38) | EP300P2RX7TRPV1TRPV3CYP2C9 | |
| SCHEMBL4440448 | 0.91 | P2RX7 (0.37) | EP300P2RX7TRPV1TRPV3 | |
| SCHEMBL4429672 | 0.90 | P2RX7 (0.38) | EP300P2RX7TRPV1TRPV3 | |
| SCHEMBL4434631 | 0.90 | P2RX7 (0.38) | EP300P2RX7TRPV1TRPV3 | |
| SCHEMBL4429561 | 0.89 | P2RX7 (0.37) | EP300P2RX7TRPV1TRPV3PTGES | |
| SCHEMBL4433047 | 0.89 | P2RX7 (0.37) | EP300P2RX7TRPV1TRPV3PTGES | |
| SCHEMBL4440242 | 0.89 | P2RX7 (0.37) | EP300P2RX7TRPV1TRPV3PTGES |
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 |
|---|---|---|---|---|---|---|---|
| EP-2114867-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008107335-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-09-12 | — | — | WO | disclosed |