Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TET2 | Q6N021 | 4/20 | 0.31 |
| ▸ | TET3 | O43151 | 1/20 | 0.31 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 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 | |
|---|---|---|---|---|
| SCHEMBL28703822 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TET2TET3TET1TGFBR1 | |
| SCHEMBL6891698 | 0.80 | ALDH1A1 (0.42) | ALDH1A1TET2TET3TET1TGFBR1 | |
| SCHEMBL29044144 | 0.80 | TET2 (0.52) | TET2TET3TET1 | |
| SCHEMBL4887464 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TET2TGFBR1EGLN1 | |
| SCHEMBL23466342 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TET2TET3TET1 | |
| SCHEMBL12622896 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TET2TET3TET1 | |
| SCHEMBL12622895 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TET2TET3TET1 | |
| SCHEMBL12628535 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TET2TET3TET1 | |
| SCHEMBL6208921 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TET2TET3TET1TGFBR1 | |
| SCHEMBL9747111 | 0.76 | ALDH1A1 (0.42) | ALDH1A1TET2TGFBR1EGLN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170191089-A1 | ITACONIC ACID AND ITACONATE METHYLESTER AND DIMETHYLESTER PRODUCTION | DSM IP ASSETS B.V. (NL) | 2017-07-06 | — | — | US | disclosed |