Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MGLL | Q99685 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13486202 | 0.88 | — | — | |
| SCHEMBL93275 | 0.88 | — | — | |
| Methane SCHEMBL6350439 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MGLLTP53CYP3A4 | |
| SCHEMBL28191215 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MGLLTP53CYP3A4 | |
| Cyclohexane SCHEMBL6352702 | 0.84 | ALDH1A1 (0.52) | ALDH1A1MGLLTP53CYP3A4 | |
| Acrylic Acid SCHEMBL28879557 | 0.83 | ALDH1A1 (0.57) | ALDH1A1MGLLTP53CYP3A4 | |
| Acrylic Acid SCHEMBL31248113 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MGLLTP53CYP3A4 | |
| Acrylic Acid SCHEMBL15421066 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MGLLTP53CYP3A4 | |
| Acrylic Acid SCHEMBL28040943 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MGLLTP53CYP3A4 | |
| Acrylic Acid SCHEMBL29984585 | 0.82 | TSHR (0.51) | MGLL |
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 |
|---|---|---|---|---|---|---|---|
| US-4469615-A | Water treating compositions | KOHRYU INDUSTRIAL CO. LTD. (JP) | 1984-09-04 | — | — | US | disclosed |