Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 9/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18311785 | 0.88 | ALDH1A1 (0.66) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 | |
| SCHEMBL11802411 | 0.85 | ALDH1A1 (0.67) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 | |
| SCHEMBL11130672 | 0.79 | ALDH1A1 (0.56) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 | |
| SCHEMBL15505827 | 0.78 | ALDH1A1 (0.66) | ALDH1A1CYP3A4HSD17B10HPGDMAPT | |
| SCHEMBL29706072 | 0.78 | ALDH1A1 (0.66) | ALDH1A1CYP3A4HSD17B10HPGDMAPT | |
| SCHEMBL30560684 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL5370150 | 0.74 | ALDH1A1 (0.70) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 | |
| SCHEMBL15087243 | 0.74 | CYP3A4 (0.32) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL3337526 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 | |
| SCHEMBL9513153 | 0.74 | ALDH1A1 (0.91) | ALDH1A1CYP3A4HSD17B10HPGDMEN1 |
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-2013098175-A1 | CROSSLINKABLE ARYLAMINE COMPOUNDS | SOLVAY SA (BE) | 2013-07-04 | — | — | WO | disclosed |