Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.53 |
| ▸ | FEN1 | P39748 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL19707920 | 0.91 | KMT2A (0.50) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL15437795 | 0.91 | ALDH1A1 (0.64) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL27676491 | 0.87 | RHOC (0.53) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19707317 | 0.87 | AGTR1 (0.48) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL9768107 | 0.85 | ALPL (0.51) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19707256 | 0.83 | ERCC5 (0.55) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL1577137 | 0.81 | SMN1; SMN2 (0.49) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19707528 | 0.80 | ALDH1A1 (0.43) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL15020831 | 0.80 | ALDH1A1 (0.56) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL30444865 | 0.80 | CA12 (0.73) | ALDH1A1AGTR1SMN1; SMN2NPC1RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |
| EP-0028305-B1 | DIARYL COMPOUNDS AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-02-01 | — | — | EP | disclosed |
| EP-0028305-A1 | Diaryl compounds and pharmaceutical formulations containing them | THE WELLCOME FOUNDATION LIMITED (GB) | 1981-05-13 | — | — | EP | disclosed |