Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.36 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
| ▸ | BHMT | Q93088 | 3/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12438551 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPTPTGS1TP53KIF11 | |
| SCHEMBL2875767 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPTPTGS1TP53KIF11 | |
| SCHEMBL6555262 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPTPTGS1TP53KIF11 | |
| SCHEMBL6501684 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPTPTGS1TP53KIF11 | |
| SCHEMBL19371196 | 0.88 | ALDH1A1 (0.48) | ALDH1A1MAPTPTGS1TP53KIF11 | |
| SCHEMBL7876560 | 0.82 | ALDH1A1 (0.52) | ALDH1A1MAPTPTGS1KIF11SLC7A5 | |
| SCHEMBL7418366 | 0.82 | ALDH1A1 (0.52) | ALDH1A1MAPTPTGS1KIF11SLC7A5 | |
| SCHEMBL7184921 | 0.82 | ALDH1A1 (0.52) | ALDH1A1MAPTPTGS1KIF11SLC7A5 | |
| SCHEMBL436388 | 0.80 | PTGS1 (0.56) | ALDH1A1MAPTPTGS1KIF11SLC7A5 | |
| SCHEMBL21443801 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPTPTGS1KIF11SLC7A5 |
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-1532976-A2 | Compositions comprising organic disulfides, cysteine sulfoxides, sulfones, sulfoximines or other sulfur containing substances and their use in therapy in combination with radiation | Holt, John Alfred Gorton (AU) | 2005-05-25 | — | — | EP | disclosed |
| EP-0531031-B1 | Compositions for use in cancer therapy | HOLT JOHN ALFRED GORTON (AU) | 1995-11-02 | — | — | EP | disclosed |
| EP-0531031-A1 | Compositions for use in cancer therapy | Holt, John Alfred Gorton (AU) | 1993-03-10 | — | — | EP | disclosed |