Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8546243 | 0.73 | ALDH1A1 (0.60) | ALDH1A1CYP3A4ALOX15HIF1A | |
| SCHEMBL1180554 | 0.71 | — | — | |
| SCHEMBL28133271 | 0.67 | — | — | |
| SCHEMBL2005231 | 0.67 | ALDH1A1 (0.90) | ALDH1A1CYP3A4ALOX15HIF1A | |
| Methyl Alcohol SCHEMBL28639463 | 0.61 | — | — | |
| Acetonitrile SCHEMBL8836994 | 0.61 | ALDH1A1 (0.75) | ALDH1A1CYP3A4ALOX15HIF1A | |
| Chloroform SCHEMBL28563775 | 0.55 | CA2 (0.55) | ALDH1A1 | |
| SCHEMBL11340227 | 0.52 | — | — | |
| SCHEMBL10635939 | 0.50 | — | — | |
| SCHEMBL3150854 | 0.50 | — | — |
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-0031938-B1 | USE OF ARYLOXY(THIO)CARBOXYLIC ACID NITRILES AND AMIDOXIMES AS ANTIDOTES AGAINST HERBICIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-03-27 | — | — | EP | claimed |