Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | RARG | P13631 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.47 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10832272 | 0.86 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL2816306 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL10832268 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL381081 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL18510019 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL15902594 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL6902109 | 0.82 | L3MBTL1 (0.49) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL21959864 | 0.82 | MMP9 (0.54) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL2135542 | 0.81 | POLB (0.46) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL2135402 | 0.81 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021200009-A1 | NEGATIVE RESIST COMPOSITION | 住友化学株式会社 | 2021-10-07 | — | — | WO | disclosed |