Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 2/20 | 0.31 |
| ▸ | RARG | P13631 | 2/20 | 0.31 |
| ▸ | RARA | P10276 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | RBP4 | P02753 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11447552 | 0.77 | ALDH1A1 (0.33) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL23052819 | 0.73 | ALDH1A1 (0.58) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL11455628 | 0.71 | CYP1A2 (0.36) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL14880058 | 0.70 | CYP1A2 (0.38) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL14880056 | 0.70 | CYP1A2 (0.38) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL11323414 | 0.70 | CYP1A2 (0.35) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL3396757 | 0.68 | CYP1A2 (0.39) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL11356723 | 0.67 | CYP1A2 (0.38) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL11447770 | 0.67 | CYP1A2 (0.38) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 | |
| SCHEMBL12813207 | 0.67 | CYP1A2 (0.35) | ALDH1A1LMNAPTGS1DRD3SLCO1B3 |
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-2021038637-A1 | NOVEL VITAMIN A DERIVATIVE AND METHOD FOR PRODUCING SAME | リファインホールディングス株式会社 | 2021-03-04 | — | — | WO | disclosed |