Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.39 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | BCR | P11274 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | PRKACG | P22612 | 1/20 | 0.36 |
| ▸ | PRKACB | P22694 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL1119249 | 0.84 | ALOX5 (0.54) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL8990149 | 0.77 | GABRA1 (0.52) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL18419016 | 0.76 | ALOX5 (0.69) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL31456038 | 0.74 | ALOX5 (0.45) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL4463386 | 0.74 | MEN1 (0.48) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL18894018 | 0.74 | ALOX5 (0.45) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL6657250 | 0.72 | CYP3A4 (0.65) | CYP3A4CA1CA2ALDH1A1ALOX15 | |
| SCHEMBL1098389 | 0.71 | CA2 (0.43) | CYP3A4CA1CA2ALDH1A1TSHR | |
| SCHEMBL5090529 | 0.71 | CA2 (0.77) | CYP3A4ALOX5PTGS2CA1CA2 | |
| SCHEMBL8797591 | 0.71 | ALOX5 (0.47) | CYP3A4ALOX5PTGS2CA1CA2 |
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-0542671-B1 | Substituted hydroquinone derivatives as intermediates of benzofuran derivatives | CIBA GEIGY AG (CH) | 1997-01-02 | — | — | EP | claimed |