Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL15308135 | 0.87 | PLK1 (0.37) | TRPA1CYP2A6ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL24467914 | 0.81 | TRPA1 (0.43) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL10274472 | 0.80 | TRPA1 (0.46) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL29661799 | 0.80 | TRPA1 (0.46) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL28274771 | 0.78 | FOLH1 (0.42) | MAPTL3MBTL1AKR1C3AKR1C2POLB | |
| SCHEMBL13019662 | 0.78 | TTR (0.36) | — | |
| SCHEMBL444673 | 0.77 | TRPA1 (0.48) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL8384809 | 0.76 | TRPA1 (0.43) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL14102324 | 0.76 | S1PR1 (0.46) | TRPA1CYP2A6CYP1A2ALDH1A1NPC1 | |
| SCHEMBL16526930 | 0.76 | MAPT (0.39) | CYP2A6CYP1A2MAPTSMN1; SMN2L3MBTL1 |
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-2023074169-A1 | PRIMER LAYER-FORMING COMPOSITION, LAMINATE, AND METHOD FOR DECOMPOSING LAMINATE | 日産化学株式会社 | 2023-05-04 | — | — | WO | disclosed |