Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 3/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5569807 | 0.82 | ALDH1A1 (0.71) | ALDH1A1ACHEPGRGAAPTGS1 | |
| SCHEMBL11207617 | 0.75 | ALDH1A1 (0.79) | ALDH1A1ACHEPGRGAAPTGS1 | |
| Fenobucarb SCHEMBL29368514 | 0.74 | ALDH1A1 (0.58) | ALDH1A1ACHEPGRGAAPTGS1 | |
| Fenobucarb SCHEMBL6740176 | 0.74 | ALDH1A1 (0.58) | ALDH1A1ACHEPGRGAAPTGS1 | |
| Fenobucarb SCHEMBL73674 | 0.74 | ALDH1A1 (0.58) | ALDH1A1ACHEPGRGAAPTGS1 | |
| Fenobucarb SCHEMBL6446466 | 0.72 | ALDH1A1 (0.47) | ALDH1A1ACHEPGRGAAPTGS1 | |
| SCHEMBL11852286 | 0.69 | ALDH1A1 (0.64) | ALDH1A1ACHEPGRGAAPTGS1 | |
| SCHEMBL11848573 | 0.69 | ALDH1A1 (0.68) | ALDH1A1ACHEPGRGAAPTGS1 | |
| SCHEMBL11509640 | 0.69 | ALDH1A1 (0.68) | ALDH1A1ACHEPGRGAAPTGS1 | |
| SCHEMBL11855036 | 0.69 | ALDH1A1 (0.62) | ALDH1A1ACHEPGRGAAPTGS1 |
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-1651034-A2 | ORGANIC COMPOUNDS | Novartis AG (CH) | 2006-05-03 | — | — | EP | disclosed |
| WO-2005013687-A2 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2005-02-17 | — | — | WO | disclosed |