Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.43 |
| ▸ | FNTB | P49356 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7543855 | 1.00 | KIF11 (0.48) | KIF11IDO1LTA4HALDH1A1L3MBTL1 | |
| SCHEMBL30131214 | 0.87 | IDO1 (0.58) | KIF11IDO1ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL1374123 | 0.87 | IDO1 (0.58) | KIF11IDO1ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL1374126 | 0.87 | IDO1 (0.58) | KIF11IDO1ALDH1A1L3MBTL1CYP1A2 | |
| Hydrochloric Acid SCHEMBL29398539 | 0.85 | IDO1 (0.61) | KIF11IDO1ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL27269055 | 0.78 | IDO1 (0.49) | IDO1LTA4HALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL30916032 | 0.78 | SLC15A1 (0.57) | LTA4HALDH1A1L3MBTL1SLC1A3SLC1A1 | |
| SCHEMBL7470329 | 0.78 | SLC15A1 (0.57) | LTA4HALDH1A1L3MBTL1SLC1A3SLC1A1 | |
| SCHEMBL8249778 | 0.78 | SLC15A1 (0.57) | LTA4HALDH1A1L3MBTL1SLC1A3SLC1A1 | |
| Hydrochloric Acid SCHEMBL27452128 | 0.78 | LTA4H (0.56) | IDO1LTA4HALDH1A1L3MBTL1SLC1A3 |
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-1209147-A1 | CARBOXYLIC ACID DERIVATIVES AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2002-05-29 | — | — | EP | disclosed |