Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL21663929 | 0.93 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL19738514 | 0.91 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL19152327 | 0.88 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL12193266 | 0.88 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL13177396 | 0.88 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL2180914 | 0.88 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL10001584 | 0.88 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL30574576 | 0.88 | HSD17B10 (0.40) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL24531260 | 0.88 | HSD17B10 (0.40) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR | |
| SCHEMBL19738488 | 0.87 | HSD17B10 (0.43) | ALDH1A1L3MBTL1HSD17B10TDP1TSHR |
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-2021135750-A1 | ORGANIC COMPOUND, APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE | 陕西莱特光电材料股份有限公司 | 2021-07-08 | — | — | WO | disclosed |