Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3457775 | 0.89 | HSD11B1 (0.42) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL29141636 | 0.81 | HSD11B1 (0.52) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL29112390 | 0.77 | HSD11B1 (0.54) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL24540861 | 0.77 | HSD11B1 (0.54) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL29112392 | 0.77 | HSD11B1 (0.54) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL20815347 | 0.75 | SMN1; SMN2 (0.40) | SMN1; SMN2HSD11B1CYP1A2HTTATM | |
| SCHEMBL28802591 | 0.74 | EPHX1 (0.34) | — | |
| SCHEMBL28608870 | 0.70 | — | — | |
| SCHEMBL29603931 | 0.69 | HSD11B1 (0.39) | HSD11B1CYP1A2HTTATMALDH1A1 | |
| SCHEMBL14872134 | 0.68 | EPHX1 (0.36) | — |
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-2022145163-A1 | COMPOSITION FOR ORAL CAVITY | ライオン株式会社 | 2022-07-07 | — | — | WO | disclosed |