Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | DDAH1 | O94760 | 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 | |
|---|---|---|---|---|
| SCHEMBL5479725 | 0.95 | — | — | |
| SCHEMBL5478935 | 0.87 | TSHR (0.32) | TSHRALDH1A1 | |
| SCHEMBL5480624 | 0.84 | ZDHHC7 (0.41) | ALDH1A1 | |
| SCHEMBL5484202 | 0.84 | ZDHHC7 (0.41) | ALDH1A1 | |
| SCHEMBL20955974 | 0.83 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL5483249 | 0.81 | ABCB11 (0.31) | — | |
| SCHEMBL16892711 | 0.80 | — | — | |
| SCHEMBL12544798 | 0.77 | TSHR (0.32) | TSHRALDH1A1 | |
| SCHEMBL12311562 | 0.74 | ENPP2 (0.37) | ALDH1A1 | |
| SCHEMBL5476439 | 0.73 | ENPP2 (0.33) | ALDH1A1DDAH1 |
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 |