Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5483539 | 0.88 | CTSK (0.32) | ALDH1A1TSHRCTSK | |
| SCHEMBL5476277 | 0.87 | TSHR (0.41) | ALDH1A1TSHRTHRBKDM4E | |
| SCHEMBL5483242 | 0.87 | MEN1 (0.33) | ALDH1A1KDM4E | |
| SCHEMBL11631788 | 0.83 | TSHR (0.39) | ALDH1A1TSHRTHRB | |
| SCHEMBL5916675 | 0.83 | USP2 (0.39) | ALDH1A1TSHRKDM4E | |
| SCHEMBL5480810 | 0.80 | PLA2G2C (0.41) | ALDH1A1 | |
| SCHEMBL7054088 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHRTHRB | |
| SCHEMBL5484842 | 0.78 | MEN1 (0.35) | ALDH1A1 | |
| SCHEMBL5480647 | 0.78 | PRKCA (0.36) | ALDH1A1TSHRTHRBCTSKKDM4E | |
| SCHEMBL643415 | 0.77 | TSHR (0.41) | ALDH1A1TSHRTHRBCTSK |
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-1744394-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2007-01-17 | — | — | EP | disclosed |