Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | LAP3 | P28838 | 1/20 | 0.41 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7208161 | 0.94 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL31294203 | 0.87 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL6946125 | 0.87 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL7346902 | 0.86 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL27691294 | 0.86 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL6946124 | 0.85 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL12481136 | 0.81 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL12481988 | 0.81 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL6703901 | 0.80 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1TDP1KMT2AMAPK1 | |
| SCHEMBL29256550 | 0.79 | MMP8 (0.52) | ALDH1A1L3MBTL1TDP1KMT2AMEN1 |
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-6613934-B1 | Enzymatic partial hydrolysis of a diester of malonic acid | DEGUSSA AG (DE) | 2003-09-02 | — | — | US | claimed |