Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | MMP8 | P22894 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL685704 | 1.00 | TRPA1 (0.48) | TRPA1KLF10NFKB1MMP2MMP9 | |
| SCHEMBL13899836 | 0.85 | TRPA1 (0.50) | TRPA1GABRA1GABRB2ALDH1A1HIF1A | |
| SCHEMBL27837492 | 0.83 | TRPA1 (0.44) | TRPA1KLF10PKMGABRA1GABRB2 | |
| SCHEMBL11928831 | 0.83 | ALDH1A1 (0.43) | TRPA1NFKB1MMP2MMP9MMP8 | |
| SCHEMBL4613626 | 0.82 | GABRA1 (0.66) | TRPA1GABRA1GABRB2ALDH1A1CYP3A4 | |
| SCHEMBL15524685 | 0.82 | TRPA1 (0.47) | TRPA1GABRA1GABRB2ALDH1A1CYP3A4 | |
| SCHEMBL14760945 | 0.82 | TRPA1 (0.47) | TRPA1GABRA1GABRB2ALDH1A1HIF1A | |
| SCHEMBL685611 | 0.82 | TRPA1 (0.52) | TRPA1GABRA1GABRB2ALDH1A1POLB | |
| SCHEMBL7885263 | 0.81 | TRPA1 (0.43) | TRPA1NFKB1MMP2MMP9MMP8 | |
| SCHEMBL28629080 | 0.80 | TRPA1 (0.46) | TRPA1GABRA1GABRB2ALDH1A1HIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108341960-B | Dynamic polymer containing combined dynamic covalent bonds and application thereof | 厦门天策材料科技有限公司 | 2023-08-25 | — | — | CN | disclosed |
| CN-108341961-B | Preparation and application of dynamic polymer containing combined dynamic covalent bonds | 厦门天策材料科技有限公司 | 2023-08-25 | — | — | CN | disclosed |
| CN-111040204-B | Force-induced response dynamic polymer and application thereof | 厦门天策材料科技有限公司 | 2023-01-24 | — | — | CN | disclosed |