Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.41 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1B1 | P30837 | 1/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL23444640 | 0.85 | HPGD (0.43) | TDP1NPC1ALDH1A1HSD17B10POLB | |
| SCHEMBL23444388 | 0.80 | HPGD (0.45) | TDP1NPC1ALDH1A1HSD17B10POLB | |
| SCHEMBL23445909 | 0.77 | TDP1 (0.44) | TDP1NPC1ALDH1A1TSHRALDH1A2 | |
| SCHEMBL23445922 | 0.76 | TDP1 (0.45) | TDP1NPC1ALDH1A1TSHRALDH1A2 | |
| SCHEMBL23443986 | 0.76 | HPGD (0.41) | TDP1NPC1ALDH1A1HSD17B10POLB | |
| SCHEMBL23421788 | 0.75 | HPGD (0.46) | TDP1NPC1ALDH1A1TSHRMAPT | |
| SCHEMBL10058469 | 0.75 | NPSR1 (0.41) | ALDH1A1HSD17B10POLBHPGDMEN1 | |
| SCHEMBL23445911 | 0.75 | SMN1; SMN2 (0.41) | TDP1NPC1ALDH1A1HSD17B10TSHR | |
| SCHEMBL8140843 | 0.72 | STAT3 (0.32) | MAPTSMN1; SMN2 | |
| SCHEMBL1782231 | 0.71 | L3MBTL1 (0.50) | TDP1NPC1ALDH1A1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021106947-A1 | NOVEL QUINONE DERIVATIVE AND ANTITRYPANOSOMAL AGENT CONTAINING SAME AS ACTIVE INGREDIENT | 国立大学法人群馬大学 | 2021-06-03 | — | — | WO | disclosed |