Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7554217 | 0.80 | AKR1C3 (0.41) | AKR1C3ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL250268 | 0.77 | ALDH1A1 (0.55) | AKR1C3ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL3130262 | 0.73 | AKR1C3 (0.46) | AKR1C3ALDH1A1TSHRHTTSMN1; SMN2 | |
| SCHEMBL9067969 | 0.72 | MAPT (0.41) | AKR1C3ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL11333243 | 0.72 | POLB (0.41) | AKR1C3ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL3932511 | 0.71 | ALDH1A1 (0.42) | AKR1C3ALDH1A1TSHRFBP1SMN1; SMN2 | |
| SCHEMBL5337661 | 0.71 | ALDH1A1 (0.42) | AKR1C3ALDH1A1TSHRFBP1SMN1; SMN2 | |
| SCHEMBL5702350 | 0.70 | ALDH1A1 (0.39) | AKR1C3ALDH1A1TSHRFBP1SMN1; SMN2 | |
| Acrylic Acid SCHEMBL17746692 | 0.70 | ALDH1A1 (0.52) | AKR1C3ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL23458002 | 0.70 | AKR1C3 (0.73) | AKR1C3ALDH1A1TSHRNPC1RAB9A |
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-3187179-A1 | PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS AND/OR TREATMENT OF CORNEAL AND CONJUNCTIVAL DISEASES OR PRESBYOPIA CONTAINING STILBENE COMPOUND AS ACTIVE INGREDIENT | Keio University (JP) | 2017-07-05 | — | — | EP | disclosed |