Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL19825851 | 1.00 | ALDH1A1 (0.44) | ALDH1A1HSD17B10EPHX1SIGMAR1KDM1A | |
| SCHEMBL26355434 | 0.97 | ALDH1A1 (0.42) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL19825848 | 0.97 | ALDH1A1 (0.47) | ALDH1A1HSD17B10KDM1AMAOB | |
| SCHEMBL23697414 | 0.92 | ALDH1A1 (0.42) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL24910117 | 0.92 | ALDH1A1 (0.47) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL23367295 | 0.92 | ALDH1A1 (0.39) | ALDH1A1KDM1AMAOB | |
| SCHEMBL24915205 | 0.89 | ALDH1A1 (0.44) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL22821763 | 0.89 | ALDH1A1 (0.44) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL24914727 | 0.89 | ALDH1A1 (0.44) | ALDH1A1HSD17B10EPHX1SIGMAR1 | |
| SCHEMBL13917687 | 0.88 | KDM1A (0.34) | KDM1AMAOB |
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-2012030518-A1 | PHOTOCHROMIC MATERIALS HAVING EXTENDED PI-CONJUGATED SYSTEMS AND COMPOSITIONS AND ARTICLES INCLUDING THE SAME | TRANSITIONS OPTICAL, INC. (US) | 2012-03-08 | — | — | WO | disclosed |