Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.71 |
| ▸ | TSHR | P16473 | 1/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.71 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.60 |
| ▸ | PGR | P06401 | 1/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.60 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.60 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.60 |
| ▸ | DGKA | P23743 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 2/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | PRKCA | P17252 | 2/20 | 0.52 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.52 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18960608 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL7053932 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL18960823 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL18960824 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL18960607 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL28537632 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL28528192 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL11302612 | 0.93 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL11302609 | 0.93 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL23595590 | 0.93 | ALOX15 (0.80) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 |
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-1249236-A1 | ANTICANCER AGENTS, PERFUMES OR FOODS AND DRINKS CONTAINING $g(v)-HYDROXYFATTY ACIDS | SODA AROMATIC COMPANY, LIMITED (JP) | 2002-10-16 | — | — | EP | disclosed |