Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | CDC25B | P30305 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | FADS1 | O60427 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12956003 | 0.96 | ALDH1A1 (0.58) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL13175278 | 0.95 | ALDH1A1 (0.51) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL12955697 | 0.93 | ALDH1A1 (0.57) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL4582509 | 0.92 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL12955828 | 0.90 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL12955735 | 0.89 | ALDH1A1 (0.57) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL12955673 | 0.89 | ALDH1A1 (0.57) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL12193003 | 0.89 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL1034201 | 0.87 | ALDH1A1 (0.70) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B | |
| SCHEMBL29432319 | 0.87 | ALDH1A1 (0.70) | ALDH1A1HSD17B10CYP3A4HPGDCDC25B |
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-1794258-B1 | NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME(4) | LG CHEMICAL LTD (KR) | 2010-09-01 | — | — | EP | disclosed |