Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | HCK | P08631 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL506514 | 1.00 | TRPA1 (0.40) | TRPA1S1PR1DGAT1SCN10ACHEK1 | |
| SCHEMBL10229621 | 0.88 | TRPA1 (0.36) | TRPA1S1PR1DGAT1SCN10ACHEK1 | |
| SCHEMBL12923711 | 0.81 | ACACB (0.44) | SCN10AACACBALOX5APFEN1PIK3CD | |
| SCHEMBL2335107 | 0.78 | KDR (0.41) | ACACBALOX5APFEN1CTSSKDR | |
| SCHEMBL19614572 | 0.76 | GAA (0.44) | TRPA1NR3C1 | |
| SCHEMBL19614569 | 0.76 | GAA (0.44) | TRPA1NR3C1 | |
| SCHEMBL250730 | 0.76 | GAA (0.44) | TRPA1NR3C1 | |
| SCHEMBL22397178 | 0.75 | TRPA1 (0.43) | TRPA1DGAT1CHEK1ALOX5APFEN1 | |
| SCHEMBL29078782 | 0.75 | ALOX5AP (0.37) | TRPA1CHEK1ALOX5APFEN1NSD2 | |
| SCHEMBL29620884 | 0.74 | TRPA1 (0.55) | TRPA1DGAT1SCN10AALOX5APFEN1 |
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-104837818-A | Pyridine-2-amides useful as CB2 agonists | HOFFMANN LA ROCHE | 2015-08-12 | — | — | CN | disclosed |