Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.43 |
| ▸ | KAT6A | Q92794 | 3/20 | 0.40 |
| ▸ | VNN1 | O95497 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4430738 | 0.90 | MRGPRX4 (0.43) | MRGPRX4MEN1NPC1RAB9AKMT2A | |
| SCHEMBL3735487 | 0.80 | MAOB (0.51) | MRGPRX4MAOBNAMPTMEN1NPC1 | |
| SCHEMBL3747705 | 0.73 | MRGPRX4 (0.47) | MRGPRX4KAT6AVNN1TRPM8CHRM2 | |
| SCHEMBL2134167 | 0.72 | HTR2C (0.56) | KAT6AVNN1ITKCHRM3NAMPT | |
| SCHEMBL3735485 | 0.71 | MAOB (0.51) | MAOBNAMPT | |
| SCHEMBL3729438 | 0.70 | NPC1 (0.50) | MRGPRX4MAOBMEN1NPC1RAB9A | |
| SCHEMBL17065159 | 0.67 | CES2 (0.51) | MRGPRX4KAT6AEGFRITKMAOB | |
| SCHEMBL690501 | 0.67 | KAT6A (0.54) | MRGPRX4KAT6AVNN1MAOBNAMPT | |
| SCHEMBL2094983 | 0.66 | KAT6A (0.52) | MRGPRX4KAT6AMAOBNAMPT | |
| SCHEMBL16502085 | 0.66 | TAS1R3 (0.51) | MRGPRX4KAT6ATRPM8MAOB |
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 |