Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 7/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.43 |
| ▸ | AR | P10275 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13359801 | 0.91 | TDP1 (0.48) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL11141885 | 0.89 | TDP1 (0.46) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL29657745 | 0.86 | TDP1 (0.52) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL29948126 | 0.86 | TDP1 (0.52) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL1397101 | 0.86 | PTGS1 (0.68) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL921090 | 0.86 | TDP1 (0.52) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL172412 | 0.84 | TDP1 (0.50) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL30142684 | 0.83 | TP53 (0.54) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL29465801 | 0.83 | TP53 (0.54) | TDP1TP53TRPA1PTGS1CACNA1C | |
| SCHEMBL217919 | 0.83 | TP53 (0.54) | TDP1TP53TRPA1PTGS1CACNA1C |
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 |
|---|---|---|---|---|---|---|---|
| CN-110431177-A | Curable composition, in particular as primer for the adhesion of crystalline rubbers to substrates | HENKEL AG & CO KGAA | 2019-11-08 | — | — | CN | disclosed |