Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 14/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4441829 | 0.86 | P2RX7 (0.43) | P2RX7CYP3A4 | |
| SCHEMBL4435804 | 0.84 | HSD11B1 (0.45) | HSD11B1 | |
| SCHEMBL28857385 | 0.77 | RAB9A (0.43) | P2RX7HSD11B1 | |
| SCHEMBL4440473 | 0.76 | HDAC4 (0.43) | P2RX7GPR139CYP3A4 | |
| SCHEMBL4433937 | 0.75 | NR1I2 (0.38) | P2RX7GPR139CYP3A4 | |
| SCHEMBL4434384 | 0.75 | P2RX7 (0.48) | P2RX7CYP3A4 | |
| SCHEMBL4434783 | 0.74 | P2RX3 (0.35) | P2RX7GPR139CYP3A4 | |
| SCHEMBL4441226 | 0.74 | GAA (0.37) | P2RX7GPR139CYP3A4 | |
| SCHEMBL4428091 | 0.73 | P2RX7 (0.38) | P2RX7CYP3A4 | |
| SCHEMBL4434673 | 0.72 | P2RX7 (0.42) | P2RX7CYP3A4 |
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 |