Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.58 |
| ▸ | MAPT | P10636 | 7/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.58 |
| ▸ | APP | P05067 | 4/20 | 0.58 |
| ▸ | SNCA | P37840 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.58 |
| ▸ | RBP4 | P02753 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.47 |
| ▸ | SLCO1B1 | Q9Y6L6 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 5/20 | 0.44 |
| ▸ | RARA | P10276 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23052818 | 0.87 | ALDH1A1 (0.64) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL23052821 | 0.86 | ALDH1A1 (0.61) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL23045082 | 0.79 | ALDH1A1 (0.63) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL18229198 | 0.76 | ALDH1A1 (0.60) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL7651177 | 0.76 | ALDH1A1 (0.60) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL11508084 | 0.76 | ALDH1A1 (0.60) | ALDH1A1MAPTCYP3A4APPSNCA | |
| Retinol SCHEMBL21270044 | 0.74 | ALDH1A1 (0.91) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL23052819 | 0.74 | ALDH1A1 (0.58) | ALDH1A1MAPTCYP3A4APPSNCA | |
| Retinol SCHEMBL80427 | 0.74 | ALDH1A1 (0.91) | ALDH1A1MAPTCYP3A4APPSNCA | |
| Retinol SCHEMBL7507482 | 0.74 | ALDH1A1 (0.91) | ALDH1A1MAPTCYP3A4APPSNCA |
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 |