Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.78 |
| ▸ | MAPT | P10636 | 7/20 | 0.78 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.78 |
| ▸ | RXRA | P19793 | 5/20 | 0.78 |
| ▸ | RARA | P10276 | 4/20 | 0.78 |
| ▸ | RARB | P10826 | 4/20 | 0.78 |
| ▸ | RARG | P13631 | 4/20 | 0.78 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.78 |
| ▸ | APP | P05067 | 4/20 | 0.78 |
| ▸ | SNCA | P37840 | 4/20 | 0.78 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.78 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.78 |
| ▸ | RXRB | P28702 | 2/20 | 0.78 |
| ▸ | RXRG | P48443 | 2/20 | 0.78 |
| ▸ | RORC | P51449 | 2/20 | 0.78 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.78 |
| ▸ | HTR2B | P41595 | 2/20 | 0.78 |
| ▸ | BLM | P54132 | 2/20 | 0.78 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.78 |
| ▸ | DRD3 | P35462 | 2/20 | 0.78 |
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 | |
|---|---|---|---|---|
| SCHEMBL2582672 | 0.91 | ALDH1A1 (0.78) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL10619245 | 0.90 | ALDH1A1 (0.78) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL10619239 | 0.90 | ALDH1A1 (0.78) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL10848683 | 0.90 | ALDH1A1 (0.74) | ALDH1A1MAPTCYP3A4RXRARARA | |
| Beta Carotene SCHEMBL4092791 | 0.90 | ALDH1A1 (0.89) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL10623339 | 0.89 | ALDH1A1 (0.88) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL10623334 | 0.89 | ALDH1A1 (0.88) | ALDH1A1MAPTCYP3A4RXRARARA | |
| Beta Carotene SCHEMBL6650927 | 0.89 | ALDH1A1 (0.92) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL5202483 | 0.88 | ALDH1A1 (0.81) | ALDH1A1MAPTCYP3A4RXRARARA | |
| SCHEMBL20211980 | 0.88 | ALDH1A1 (0.81) | ALDH1A1MAPTCYP3A4RXRARARA |
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-0009793-A2 | Pharmaceutical composition containing a derivative of 2-(retinylidene)-malonic acid, manufacturing process and application | BASF Aktiengesellschaft (DE) | 1980-04-16 | — | — | EP | disclosed |