Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOD1 | P00441 | 11/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | DAO | P14920 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL19559198 | 0.79 | SOD1 (0.72) | SOD1CYP2C19DAORAB9A | |
| SCHEMBL19683721 | 0.77 | SOD1 (0.59) | SOD1CYP2C19DAO | |
| SCHEMBL12297888 | 0.74 | SOD1 (1.00) | SOD1CYP2C19DAOALDH1A1NPC1 | |
| SCHEMBL12297382 | 0.73 | SOD1 (1.00) | SOD1CYP2C19DAOALDH1A1TSHR | |
| SCHEMBL19559177 | 0.73 | SOD1 (0.77) | SOD1CYP2C19DAOPDPK1 | |
| SCHEMBL5918492 | 0.70 | RIPK1 (0.46) | — | |
| SCHEMBL12297886 | 0.69 | SOD1 (1.00) | SOD1CYP2C19DAO | |
| SCHEMBL19262073 | 0.68 | NR5A1 (0.49) | ALDH1A1TSHR | |
| SCHEMBL12297901 | 0.68 | SOD1 (0.71) | SOD1CYP2C19DAO | |
| SCHEMBL19262071 | 0.68 | ALDH1A3 (0.41) | CYP2C19 |
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-2367798-B1 | PYRAZOLONE DERIVATIVES USEFUL IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS | UNIV NORTHWESTERN (US) | 2018-02-28 | — | — | EP | disclosed |