Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NSD2 | O96028 | 1/20 | 0.44 |
| ▸ | SERPINE1 | P05121 | 3/20 | 0.43 |
| ▸ | TYR | P14679 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SELL | P14151 | 1/20 | 0.40 |
| ▸ | SELP | P16109 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL16672632 | 0.86 | CYP2D6 (0.62) | CYP1A2CYP2D6CYP2C19LMNAHPGD | |
| SCHEMBL4733375 | 0.85 | L3MBTL1 (0.59) | L3MBTL1NSD2SERPINE1TYRLMNA | |
| SCHEMBL873536 | 0.78 | ALDH1A1 (0.44) | L3MBTL1CYP1A2CYP2D6CYP2C19POLB | |
| SCHEMBL4738069 | 0.77 | L3MBTL1 (0.55) | L3MBTL1NSD2SERPINE1TYRLMNA | |
| SCHEMBL4735006 | 0.76 | SERPINE1 (0.46) | L3MBTL1CYP1A2CYP2D6CYP2C19NSD2 | |
| SCHEMBL16672586 | 0.76 | KMT2A (0.46) | L3MBTL1CYP1A2CYP2D6CYP2C19LMNA | |
| SCHEMBL16673620 | 0.75 | CYP1A2 (0.43) | L3MBTL1CYP1A2CYP2D6CYP2C19HPGD | |
| SCHEMBL16672633 | 0.74 | KMT2A (0.50) | L3MBTL1CYP1A2CYP2D6CYP2C19LMNA | |
| SCHEMBL27577107 | 0.74 | L3MBTL1 (0.58) | L3MBTL1NSD2SERPINE1TYRESR1 | |
| SCHEMBL16672931 | 0.73 | CHRNB2 (0.41) | L3MBTL1CYP1A2CYP2D6CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008065527-A2 | GALLIC ACID ESTERS OF FRAGRANT ALCOHOLS | GHISALBERTI CARLO (BR) | 2008-06-05 | — | — | WO | disclosed |