Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8780174 | 1.00 | ALDH1A1 (0.36) | ALDH1A1TSHRTP53 | |
| SCHEMBL18687579 | 1.00 | ALDH1A1 (0.36) | ALDH1A1TSHRTP53 | |
| SCHEMBL21653463 | 1.00 | ALDH1A1 (0.36) | ALDH1A1TSHRTP53 | |
| SCHEMBL1353040 | 0.80 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL1353039 | 0.80 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL6430277 | 0.80 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53 | |
| SCHEMBL11163492 | 0.80 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL18431012 | 0.80 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53 | |
| SCHEMBL21911820 | 0.77 | ALDH1A1 (0.30) | ALDH1A1TSHRTP53 | |
| SCHEMBL12293215 | 0.77 | HSD17B10 (0.35) | ALDH1A1TSHRTP53 |
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-2695930-B1 | POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLARIZED LIGHT-EMITTING COATING MATERIAL, NOVEL NAPHTHOLACTAM DERIVATIVE, NOVEL COUMARIN DERIVATIVE, NOVEL NILE RED DERIVATIVE, AND NOVEL ANTHRACENE DERIVATIVE | DAINIPPON INK & CHEMICALS (JP) | 2019-09-11 | — | — | EP | disclosed |