Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | IDO1 | P14902 | 5/20 | 0.50 |
| ▸ | AGXT | P21549 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6258401 | 1.00 | ALDH1A1 (0.59) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL11437812 | 0.87 | ALDH1A1 (0.68) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL8474430 | 0.83 | ALDH1A1 (0.63) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL11781106 | 0.82 | MAOB (0.48) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL5002160 | 0.81 | ALDH1A1 (0.61) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL12924871 | 0.81 | ALDH1A1 (0.61) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL7921584 | 0.79 | ALDH1A1 (0.59) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL16093275 | 0.79 | ACHE (0.62) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL1741564 | 0.79 | ALDH1A1 (0.59) | ALDH1A1ALOX15TP53CYP3A4TSHR | |
| SCHEMBL6803104 | 0.79 | ALDH1A1 (0.64) | ALDH1A1ALOX15TP53CYP3A4TSHR |
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-1346216-B1 | METHOD FOR DETERMINATION OF THE ORIGIN AND AUTHENTICITY OF MATERIALS WITH BIOLOGICAL BIOCHEMICAL AND NUTRITIONAL PHYSIOLOGICAL RELEVANCE | SCHMIDT HANNS LUDWIG (DE) | 2005-10-05 | — | — | EP | claimed |