Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.47 |
| ▸ | KIF11 | P52732 | 3/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.35 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.35 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.35 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5771954 | 0.83 | NR1H2 (0.39) | NR1H2NR1H3 | |
| SCHEMBL22580535 | 0.83 | NR1H2 (0.43) | NR1H2NR1H3KIF11CYP1A2ALDH1A1 | |
| SCHEMBL29214098 | 0.83 | NR1H2 (0.47) | NR1H2NR1H3KIF11TGM2ALDH1A1 | |
| SCHEMBL30301265 | 0.77 | TGM2 (0.46) | NR1H2NR1H3KIF11TGM2CYP1A2 | |
| SCHEMBL29214160 | 0.77 | NFE2L2 (0.38) | NR1H2NR1H3TGM2PTGS1NQO2 | |
| SCHEMBL9563524 | 0.75 | NR1H2 (0.41) | NR1H2NR1H3KIF11TGM2AHR | |
| SCHEMBL9226183 | 0.74 | NR1H2 (0.50) | NR1H2NR1H3KIF11ALDH1A1TSHR | |
| SCHEMBL12773794 | 0.74 | NR1H2 (0.60) | NR1H2NR1H3KIF11ALDH1A1TSHR | |
| SCHEMBL1052798 | 0.74 | KIF11 (0.48) | NR1H2NR1H3KIF11ALDH1A1TSHR | |
| SCHEMBL10031952 | 0.72 | AHR (0.53) | NR1H2NR1H3CYP1A2AHRPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117859229-A | Nonaqueous electrolyte and nonaqueous electrolyte secondary battery | 信越化学工业株式会社 | 2024-04-09 | — | — | CN | disclosed |