Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GSDMD | P57764 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3078858 | 0.97 | ALDH1A1 (0.40) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL11563773 | 0.94 | ALDH1A1 (0.39) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL28369634 | 0.94 | ALDH1A1 (0.39) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL28773605 | 0.94 | ALDH1A1 (0.39) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL28773566 | 0.94 | ALDH1A1 (0.39) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL20819787 | 0.94 | ALDH1A1 (0.39) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL11528790 | 0.84 | TDP1 (0.40) | ALDH1A1 | |
| SCHEMBL29121129 | 0.80 | ABCB11 (0.43) | ALDH1A1ABCB11CYP2E1PTGS1HTT | |
| SCHEMBL11734279 | 0.77 | ALDH1A1 (0.46) | ALDH1A1 | |
| SCHEMBL1241923 | 0.76 | ALDH1A1 (0.43) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5824195-A | USING N-NITROSOPHENYLHYDROXYLAMINE SALT AND/OR COPPER DIALKYLDITHIOCARBAMATE SYNERGISTIC MIXTURE AS POLYMERIZATION INHIBITORS | CHISSO CORPORATION (JP) | 1998-10-20 | — | — | US | disclosed |
| EP-0753521-A2 | Process for distilling crude acrylic silane solution | Chisso Corporation (JP) | 1997-01-15 | — | — | EP | disclosed |