Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.48 |
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | SCN4A | P35499 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | ACP1 | P24666 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4432461 | 0.77 | AHR (0.39) | DYRK1AALDH1A1NPC1MAPTKMT2A | |
| SCHEMBL11956363 | 0.77 | EPHX2 (0.65) | DYRK1ALDHAPPARAALDH1A1TDP1 | |
| SCHEMBL4431654 | 0.76 | ALDH1A1 (0.48) | DYRK1AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL4432335 | 0.74 | CES2 (0.41) | PPARAMAPTTP53 | |
| SCHEMBL23932781 | 0.74 | LDHA (0.52) | LDHAALDH1A1TDP1NPC1RAB9A | |
| SCHEMBL4432365 | 0.72 | AKR1C3 (0.43) | PPARAALDH1A1 | |
| SCHEMBL12109822 | 0.72 | MAPT (0.38) | DYRK1AALDH1A1TDP1NPC1RAB9A | |
| SCHEMBL4431561 | 0.72 | AKR1C3 (0.48) | ALDH1A1 | |
| SCHEMBL4438527 | 0.72 | CES2 (0.50) | ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL4435426 | 0.71 | CNR1 (0.40) | SMN1; SMN2 |
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 |