Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.95 |
| ▸ | GSK3B | P49841 | 3/20 | 0.95 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.95 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.95 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.95 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.54 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Phenacyl Chloride SCHEMBL2314766 | 0.97 | ALDH1A1 (1.00) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL55444 | 0.97 | ALDH1A1 (1.00) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL5139857 | 0.95 | ALDH1A1 (0.95) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL27611889 | 0.95 | ALDH1A1 (0.95) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL14715802 | 0.95 | ALDH1A1 (0.95) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL28256528 | 0.95 | ALDH1A1 (0.95) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL27757057 | 0.93 | ALDH1A1 (0.91) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL27802062 | 0.93 | ALDH1A1 (0.91) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL4787265 | 0.91 | ALDH1A1 (0.86) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 | |
| Phenacyl Chloride SCHEMBL23069548 | 0.89 | ALDH1A1 (0.83) | ALDH1A1GSK3BHIF1AMAPK1TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102731382-B | 6-(polysubstituted aryl)-4-aminopyridine manthanoate and the purposes as weedicide thereof | THE DOW AGROSCIENCES, LLC. (US) | 2015-09-02 | — | — | CN | disclosed |