Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EIF4E | P06730 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | STAT6 | P42226 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15066243 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL17420850 | 0.82 | ALDH1A1 (0.66) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL20175730 | 0.81 | ALDH1A1 (0.54) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL15066232 | 0.80 | S100A4 (0.46) | ALDH1A1TDP1ADORA1MAPTKMT2A | |
| SCHEMBL29021111 | 0.79 | ALDH1A1 (0.66) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL15055251 | 0.79 | ALDH1A1 (0.66) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL25244348 | 0.78 | ALDH1A1 (0.64) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL19651134 | 0.78 | ALDH1A1 (0.59) | ALDH1A1TDP1ADORA1MAPTMAPK1 | |
| SCHEMBL9761836 | 0.78 | ALDH1A1 (0.76) | ALDH1A1TDP1MAPK1KMT2AMEN1 | |
| SCHEMBL15055905 | 0.77 | ALDH1A1 (0.63) | ALDH1A1TDP1ADORA1MAPTMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013100507-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME | 주식회사 두산 (KR) | 2013-07-04 | — | — | WO | disclosed |
| WO-2013100507-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME | 주식회사 두산 (KR) | 2013-07-04 | — | — | WO | disclosed |