Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 6/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3352559 | 0.87 | ALDH1A1 (0.53) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL3357708 | 0.84 | ALDH1A1 (0.58) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL3354699 | 0.83 | ALDH1A1 (0.55) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL31208292 | 0.79 | ALDH1A1 (0.60) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL29490253 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL22862805 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL15833600 | 0.77 | PRKCI (0.53) | MAPK14PRKCIHSD17B10 | |
| SCHEMBL24075008 | 0.76 | HPGD (0.49) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL22862454 | 0.74 | GAA (0.53) | ALDH1A1HPGDGAAMEN1KMT2A | |
| SCHEMBL29490273 | 0.74 | GAA (0.53) | ALDH1A1HPGDGAAMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2141163-A1 | Substituted thiazolidinones, their production and utilisation as medicine | Bayer Schering Pharma AG (DE) | 2010-01-06 | — | — | EP | disclosed |