Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 5/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL340066 | 0.83 | TRPA1 (0.68) | TRPA1TP53TDP1ACHELMNA | |
| SCHEMBL29819939 | 0.83 | TRPA1 (0.68) | TRPA1TP53TDP1ACHELMNA | |
| SCHEMBL23967969 | 0.82 | MAPT (0.42) | TP53TDP1LMNAALDH1A1HPGD | |
| SCHEMBL16852427 | 0.79 | TRPA1 (0.48) | TRPA1TP53TDP1ALOX15HSD17B10 | |
| SCHEMBL8375606 | 0.79 | TP53 (0.50) | TRPA1TP53TDP1LMNAALOX15 | |
| SCHEMBL5687593 | 0.79 | CASP1 (0.63) | TRPA1TDP1LMNAALOX15HSD17B10 | |
| SCHEMBL27572785 | 0.78 | ATM (0.48) | TRPA1TP53TDP1LMNAALOX15 | |
| SCHEMBL31673873 | 0.78 | POLB (0.55) | TRPA1ACHELMNAALOX15HSD17B10 | |
| SCHEMBL23854312 | 0.78 | POLB (0.55) | TRPA1ACHELMNAALOX15HSD17B10 | |
| SCHEMBL16378659 | 0.77 | TDP1 (0.37) | TP53TDP1LMNAHSD17B10ALDH1A1 |
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-2023134594-A1 | NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT | 烟台显华科技集团股份有限公司 | 2023-07-20 | — | — | WO | disclosed |