Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | KYNU | Q16719 | 2/20 | 0.51 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.49 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.49 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7870745 | 0.84 | KYNU (0.57) | ALDH1A1KYNUSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL9064967 | 0.84 | KYNU (0.65) | KYNUSLC1A3SLC1A2SLC1A1MMP13 | |
| SCHEMBL27767605 | 0.84 | KYNU (0.65) | KYNUSLC1A3SLC1A2SLC1A1MMP13 | |
| SCHEMBL7867008 | 0.83 | KYNU (0.51) | KYNUSLC1A3SLC1A2SLC1A1MMP13 | |
| SCHEMBL7867063 | 0.83 | NPC1 (0.54) | ALDH1A1KYNUSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL6378071 | 0.82 | ALDH1A1 (0.53) | ALDH1A1SLC1A3SLC1A2SLC1A1RECQL | |
| Hydrochloric Acid SCHEMBL7207769 | 0.81 | HTT (0.55) | KYNUSLC1A3SLC1A2SLC1A1MMP13 | |
| SCHEMBL7866977 | 0.81 | KYNU (0.50) | KYNUKIF11KMT2A | |
| SCHEMBL7833538 | 0.80 | ALDH1A1 (0.51) | ALDH1A1SLC1A3SLC1A2SLC1A1RECQL | |
| SCHEMBL30423587 | 0.79 | SLC1A3 (0.52) | ALDH1A1KYNUSLC1A3SLC1A2SLC1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0994104-A1 | ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2000-04-19 | — | — | EP | claimed |
| US-6300514-B1 | INHIBITING MATRIX METALLOPROTEINASES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2001-10-09 | — | — | US | disclosed |
| EP-0994104-A1 | ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2000-04-19 | — | — | EP | disclosed |