Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 4/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.43 |
| ▸ | NAAA | Q02083 | 2/20 | 0.40 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.39 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | UGCG | Q16739 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28899643 | 0.89 | OPRK1 (0.40) | OPRM1OPRD1OPRK1OPRL1NAAA | |
| SCHEMBL30632554 | 0.83 | ALDH1A1 (0.40) | OPRK1ALDH1A1POLB | |
| SCHEMBL18342994 | 0.80 | ALDH1A1 (0.40) | ALDH1A1CHRM3 | |
| SCHEMBL5815457 | 0.79 | CHRM2 (0.40) | ALDH1A1CHRM3 | |
| SCHEMBL28899659 | 0.77 | SLC6A2 (0.38) | OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL21359025 | 0.72 | ALDH1A1 (0.49) | NAAAASAH1CSNK1EALDH1A1MMP2 | |
| SCHEMBL18248508 | 0.71 | EPHX1 (0.53) | NAAAASAH1CSNK1EALDH1A1ACER2 | |
| SCHEMBL8763769 | 0.71 | EPHX1 (0.53) | NAAAASAH1CSNK1EALDH1A1ACER2 | |
| SCHEMBL21359023 | 0.71 | EPHX1 (0.53) | NAAAASAH1CSNK1EALDH1A1ACER2 | |
| SCHEMBL7642789 | 0.71 | EPHX1 (0.53) | NAAAASAH1CSNK1EALDH1A1ACER2 |
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-115414480-A | Dianhydrogalactitol in combination with radiation for treatment of non-small cell lung cancer and glioblastoma multiforme | 德玛医药 | 2022-12-02 | — | — | CN | disclosed |