Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.78 |
| ▸ | MAPT | P10636 | 2/20 | 0.78 |
| ▸ | NSD2 | O96028 | 2/20 | 0.78 |
| ▸ | NPC1 | O15118 | 1/20 | 0.78 |
| ▸ | MITF | O75030 | 1/20 | 0.78 |
| ▸ | THRB | P10828 | 1/20 | 0.78 |
| ▸ | HTT | P42858 | 1/20 | 0.78 |
| ▸ | RECQL | P46063 | 1/20 | 0.78 |
| ▸ | RAB9A | P51151 | 1/20 | 0.78 |
| ▸ | GALK1 | P51570 | 1/20 | 0.78 |
| ▸ | BLM | P54132 | 1/20 | 0.78 |
| ▸ | ATM | Q13315 | 1/20 | 0.78 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.78 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.78 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.78 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CES1 | P23141 | 7/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1409019 | 0.71 | PTPN1 (0.54) | ALDH1A1MAPTNSD2NPC1MITF | |
| Anthraquinone SCHEMBL15309434 | 0.68 | KMT2A (0.54) | ALDH1A1MAPTNSD2NPC1MITF | |
| SCHEMBL12858677 | 0.68 | MEN1 (1.00) | ALDH1A1MAPTNSD2NPC1MITF | |
| SCHEMBL6052675 | 0.68 | MALT1 (0.64) | ALDH1A1MAPTNSD2NPC1MITF | |
| Anthraquinone SCHEMBL616605 | 0.68 | MEN1 (0.71) | ALDH1A1MAPTNPC1THRBHTT | |
| Anthraquinone SCHEMBL28758919 | 0.66 | MEN1 (0.67) | ALDH1A1MAPTNPC1THRBHTT | |
| SCHEMBL20043014 | 0.66 | MAOA (0.49) | ALDH1A1MAPTNSD2NPC1MITF | |
| SCHEMBL4629512 | 0.66 | S100A4 (0.76) | ALDH1A1MAPTNPC1THRBRECQL | |
| SCHEMBL342409 | 0.65 | KDM4E (1.00) | ALDH1A1MAPTNSD2THRBHTT | |
| SCHEMBL3341534 | 0.64 | MAPT (0.37) | ALDH1A1MAPTNSD2NPC1MITF |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0831327-B1 | Redox active compounds and their use | ROCHE DIAGNOSTICS GMBH (DE) | 2001-05-09 | — | — | EP | disclosed |
| US-6057120-A | Redox-active compounds and their use | ROCHE DIAGNOSTICS GMBH (DE) | 2000-05-02 | — | — | US | disclosed |
| EP-0831327-A1 | Redox active compounds and their use | Roche Diagnostics GmbH (DE) | 1998-03-25 | — | — | EP | disclosed |