Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL6566822 | 1.00 | ALDH1A1 (0.38) | ALDH1A1TSHRGAATHRB | |
| SCHEMBL6567270 | 0.97 | — | — | |
| SCHEMBL455723 | 0.83 | TP53 (0.31) | — | |
| SCHEMBL8617456 | 0.82 | CA2 (0.36) | — | |
| SCHEMBL9736798 | 0.80 | MEN1 (0.52) | ALDH1A1TSHRTHRB | |
| SCHEMBL11078635 | 0.79 | ALDH1A1 (0.38) | ALDH1A1TSHRGAATHRB | |
| SCHEMBL17614047 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TSHRGAATHRB | |
| Dimethylamine SCHEMBL9542068 | 0.76 | ALDH1A1 (0.50) | ALDH1A1TSHRGAATHRB | |
| SCHEMBL5839297 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TSHRTHRB | |
| SCHEMBL9639301 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TSHRTHRB |
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-0854177-B1 | Ink compositions | XEROX CORP (US) | 2004-03-31 | — | — | EP | claimed |