Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 5/20 | 0.38 |
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | MMP12 | P39900 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10307746 | 0.87 | MAPT (0.53) | CYSLTR2CYSLTR1MAPTRXFP1CES1 | |
| SCHEMBL16282701 | 0.84 | ALDH1A1 (0.49) | CYSLTR2CYSLTR1MAPTRXFP1CES1 | |
| SCHEMBL15468649 | 0.79 | CYP2C19 (0.39) | CYSLTR2CYSLTR1MAPTMMP13SMN1; SMN2 | |
| SCHEMBL15468643 | 0.78 | FOLH1 (0.38) | MAPTRXFP1TRPA1HDAC3HDAC4 | |
| SCHEMBL16751107 | 0.75 | MAPT (0.63) | MAPTRXFP1CES1HDAC3MAPK1 | |
| SCHEMBL660789 | 0.74 | HDAC1 (0.64) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL21408461 | 0.73 | HTT (0.48) | MAPTMAPK1SMN1; SMN2CYP1A2CYP2C19 | |
| Cpi 613 SCHEMBL13333201 | 0.73 | CYP2C19 (0.59) | CYSLTR2CYSLTR1MAPTRXFP1HDAC3 | |
| Cpi 613 SCHEMBL1062218 | 0.73 | CYP2C19 (0.59) | CYSLTR2CYSLTR1MAPTRXFP1HDAC3 | |
| SCHEMBL17973797 | 0.73 | MAPT (0.49) | CYSLTR2CYSLTR1MAPTRXFP1HDAC3 |
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-2695614-A1 | Lipoic acid derivatives | Cornerstone Pharmaceuticals, Inc. (US) | 2014-02-12 | — | — | EP | disclosed |