Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | ADH1B | P00325 | 1/20 | 0.35 |
| ▸ | ADH1C | P00326 | 1/20 | 0.35 |
| ▸ | ADH1A | P07327 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL107778 | 0.89 | — | — | |
| Water SCHEMBL27077266 | 0.86 | ALDH1A1 (0.40) | CA1TSHRALDH1A1TDP1ADH1B | |
| Methane SCHEMBL782703 | 0.86 | — | — | |
| SCHEMBL28765622 | 0.86 | — | — | |
| SCHEMBL7844269 | 0.86 | — | — | |
| Ethane SCHEMBL3782667 | 0.86 | — | — | |
| SCHEMBL1010069 | 0.86 | — | — | |
| SCHEMBL29190497 | 0.86 | — | — | |
| SCHEMBL19638210 | 0.79 | ALDH1A1 (0.35) | TSHRALDH1A1TDP1ADH1BADH1C | |
| SCHEMBL1260681 | 0.77 | — | — |
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-1163218-B1 | NEW SALT OF (2R,3R,4R)-3,4-DIHYDROXY-2-HYDROXYMETHYLPYRROLIDINE | NOVO NORDISK AS (DK) | 2005-08-24 | — | — | EP | claimed |