Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 4/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.38 |
| ▸ | MIF | P14174 | 3/20 | 0.38 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | BACH1 | O14867 | 1/20 | 0.34 |
| ▸ | MAFK | O60675 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21622157 | 0.95 | KEAP1 (0.40) | KEAP1NFE2L2MIFNAAAGSK3B | |
| SCHEMBL7711924 | 0.73 | EPHX1 (0.38) | NAAAALDH1A1LMNA | |
| SCHEMBL14976126 | 0.73 | EPHX1 (0.38) | NAAAALDH1A1LMNA | |
| SCHEMBL10773640 | 0.73 | EPHX1 (0.38) | NAAAALDH1A1LMNA | |
| SCHEMBL10620419 | 0.73 | EPHX1 (0.38) | NAAAALDH1A1LMNA | |
| SCHEMBL1911580 | 0.71 | EPHX1 (0.35) | NAAAALDH1A1LMNA | |
| SCHEMBL11705481 | 0.71 | EPHX1 (0.35) | NAAAALDH1A1LMNA | |
| SCHEMBL14153027 | 0.71 | EPHX1 (0.35) | NAAAALDH1A1LMNA | |
| SCHEMBL18937148 | 0.69 | CYP1A2 (0.40) | — | |
| SCHEMBL1419553 | 0.69 | CYP1A2 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020011750-A1 | FUNGICIDES TO PREVENT AND CONTROL FUNGAL PATHOGENS | Université de Lausanne (CH) | 2020-01-16 | — | — | WO | disclosed |