Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.31 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | KCNK18 | Q7Z418 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31069428 | 1.00 | ALDH1A1 (0.31) | ALDH1A1LMNAL3MBTL1CYP26A1CYP26B1 | |
| SCHEMBL31069376 | 0.94 | ALDH1A1 (0.33) | ALDH1A1CYP26A1CYP26B1PTGS1PTGS2 | |
| SCHEMBL23439063 | 0.94 | ALDH1A1 (0.33) | ALDH1A1CYP26A1CYP26B1PTGS1PTGS2 | |
| SCHEMBL23438805 | 0.87 | RARB (0.36) | ALDH1A1LMNAL3MBTL1RARBRARG | |
| SCHEMBL31069417 | 0.87 | RARB (0.36) | ALDH1A1LMNAL3MBTL1RARBRARG | |
| SCHEMBL31069466 | 0.86 | ALDH1A1 (0.38) | ALDH1A1LMNAL3MBTL1ABCG2KCNK18 | |
| SCHEMBL23439697 | 0.86 | ALDH1A1 (0.38) | ALDH1A1LMNAL3MBTL1ABCG2KCNK18 | |
| SCHEMBL31069384 | 0.86 | ALDH1A1 (0.38) | ALDH1A1LMNAL3MBTL1ABCG2KCNK18 | |
| SCHEMBL23439067 | 0.84 | RARB (0.30) | RARBRARGRXRA | |
| SCHEMBL31069430 | 0.84 | RARB (0.30) | RARBRARGRXRA |
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-2021107711-A1 | POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |