Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAP3K14 | Q99558 | 3/20 | 0.34 |
| ▸ | RARA | P10276 | 2/20 | 0.33 |
| ▸ | RARB | P10826 | 2/20 | 0.33 |
| ▸ | RARG | P13631 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.30 |
| ▸ | DYRK1B | Q9Y463 | 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 | |
|---|---|---|---|---|
| SCHEMBL9053853 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TDP1RARARARB | |
| SCHEMBL9053811 | 0.80 | RARB (0.46) | ALDH1A1HSD17B10TDP1MAP3K14RARA | |
| SCHEMBL19889345 | 0.78 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TDP1MAP3K14RARA | |
| SCHEMBL9054579 | 0.77 | MAPT (0.41) | ALDH1A1TDP1MAP3K14KDM4E | |
| SCHEMBL6668879 | 0.77 | MAP3K14 (0.36) | ALDH1A1MAP3K14TSHR | |
| SCHEMBL19889349 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HSD17B10TDP1MAP3K14RARA | |
| SCHEMBL5845932 | 0.77 | LMNA (0.42) | MAP3K14 | |
| SCHEMBL9050393 | 0.76 | ALDH1A1 (0.45) | ALDH1A1HSD17B10TDP1MAP3K14RARA | |
| SCHEMBL9053828 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL9054648 | 0.74 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5498755-A | IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS | ALLERGAN, INC. | 1996-03-12 | — | — | US | disclosed |
| WO-1996006070-A1 | DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1996-02-29 | — | — | WO | disclosed |