Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | DPYD | Q12882 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATP4A | P20648 | 2/20 | 0.39 |
| ▸ | ATP4B | P51164 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5411617 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| SCHEMBL44503 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| SCHEMBL9540538 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| (Z)-1,2-Diphenylethene SCHEMBL7653143 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| SCHEMBL44502 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| (Z)-1,2-Diphenylethene SCHEMBL7653150 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| SCHEMBL6360540 | 0.77 | NFE2L2 (0.68) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| Hydrogen Sulfide SCHEMBL3374807 | 0.74 | NFE2L2 (0.65) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| Hydrochloric Acid SCHEMBL22164137 | 0.74 | NFE2L2 (0.65) | NFE2L2TRPA1MAOBCYP19A1MAOA | |
| Hydrochloric Acid SCHEMBL22164136 | 0.74 | NFE2L2 (0.65) | NFE2L2TRPA1MAOBCYP19A1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| CN-111647018-B | Preparation method of phosphorus center chiral compound | 杭州师范大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-111647018-A | Preparation method of phosphorus center chiral compound | 杭州师范大学 | 2020-09-11 | — | — | CN | disclosed |