Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | AHR | P35869 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12129841 | 0.98 | ALDH1A1 (0.62) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15315868 | 0.98 | ALDH1A1 (0.62) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15025989 | 0.88 | L3MBTL1 (0.50) | ALDH1A1NPC1RAB9ALMNAL3MBTL1 | |
| SCHEMBL2879894 | 0.88 | L3MBTL1 (0.50) | ALDH1A1NPC1RAB9ALMNAL3MBTL1 | |
| SCHEMBL2876376 | 0.88 | L3MBTL1 (0.50) | ALDH1A1NPC1RAB9ALMNAL3MBTL1 | |
| SCHEMBL13826588 | 0.88 | ALDH1A1 (0.50) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2801074 | 0.85 | NR1H4 (0.50) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24941472 | 0.85 | RAB9A (0.49) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24940527 | 0.85 | ALDH1A1 (0.54) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL260551 | 0.85 | ALDH1A1 (0.81) | ALDH1A1AHRNPC1RAB9ASMN1; SMN2 |
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-2021057264-A1 | COMPOUND, PHOTOELECTRIC CONVERSION DEVICE, AND ELECTRONIC DEVICE | 陕西莱特光电材料股份有限公司 | 2021-04-01 | — | — | WO | disclosed |