Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29443 | 0.87 | IDO1 (0.48) | ALDH1A1MAPTLMNACA1CA2 | |
| SCHEMBL28101173 | 0.87 | IDO1 (0.48) | ALDH1A1MAPTLMNACA1CA2 | |
| SCHEMBL27275726 | 0.84 | IDO1 (0.46) | ALDH1A1MAPTLMNACA1CA2 | |
| Acetaldehyde SCHEMBL27507154 | 0.82 | IDO1 (0.44) | ALDH1A1MAPTLMNACA1CA2 | |
| SCHEMBL6608023 | 0.81 | ALDH1A1 (0.56) | HPGDMEN1KMT2AGAAL3MBTL1 | |
| SCHEMBL5473166 | 0.79 | CNR1 (0.40) | MEN1KMT2AALDH1A1MAPTHSD17B10 | |
| SCHEMBL9516537 | 0.76 | HPGD (0.78) | HPGDMEN1KMT2AGAAL3MBTL1 | |
| SCHEMBL108881 | 0.76 | HPGD (0.78) | HPGDMEN1KMT2AGAAL3MBTL1 | |
| SCHEMBL50079 | 0.76 | HPGD (0.78) | HPGDMEN1KMT2AGAAL3MBTL1 | |
| SCHEMBL3661513 | 0.76 | ALDH1A1 (0.44) | MEN1KMT2AGAAL3MBTL1NPC1 |
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-0998449-A1 | METHOD FOR AMINATING MONONUCLEAR AROMATIC COMPOUNDS AND POLYNUCLEAR COMPOUNDS CONTAINING AT LEAST ONE AROMATIC RING IN THE PRESENCE OF AN PALLADIUM COMPLEX CATALYST | Celanese Chemicals Europe GmbH (DE) | 2000-05-10 | — | — | EP | disclosed |
| WO-1999001418-A1 | METHOD FOR AMINATING MONONUCLEAR AROMATIC COMPOUNDS AND POLYNUCLEAR COMPOUNDS CONTAINING AT LEAST ONE AROMATIC RING IN THE PRESENCE OF AN PALLADIUM COMPLEX CATALYST | CELANESE CHEMICALS EUROPE GMBH (DE) | 1999-01-14 | — | — | WO | disclosed |