Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24521269 | 0.98 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL23034173 | 0.98 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL23033885 | 0.98 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL23034172 | 0.97 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL24521137 | 0.96 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL23034174 | 0.96 | ALDH1A1 (0.40) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL23034469 | 0.96 | ALDH1A1 (0.40) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL26244329 | 0.94 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL24521339 | 0.94 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10TP53SMN1; SMN2 | |
| SCHEMBL25682137 | 0.94 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10TP53SMN1; 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-2021034039-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2021-02-25 | — | — | WO | disclosed |