Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | RXRA | P19793 | 8/20 | 0.48 |
| ▸ | RARA | P10276 | 8/20 | 0.48 |
| ▸ | RARB | P10826 | 6/20 | 0.48 |
| ▸ | RARG | P13631 | 6/20 | 0.48 |
| ▸ | RXRB | P28702 | 4/20 | 0.48 |
| ▸ | RXRG | P48443 | 4/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.48 |
| ▸ | RORC | P51449 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HTR2B | P41595 | 2/20 | 0.48 |
| ▸ | BLM | P54132 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5532432 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL12494087 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL15609523 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL12494830 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL30575788 | 0.94 | ALDH1A1 (0.63) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL12493700 | 0.94 | ALDH1A1 (0.63) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL15609079 | 0.94 | ALDH1A1 (0.63) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL29435876 | 0.88 | ALDH1A1 (0.58) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL14566281 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT | |
| SCHEMBL14566202 | 0.86 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0263492-B1 | RETINOIDS, THEIR PREPARATION AND USE AS PHARMACEUTICAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-03-13 | — | — | EP | claimed |