Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 13/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7097138 | 0.90 | TRPA1 (0.55) | TRPA1 | |
| SCHEMBL7099747 | 0.88 | TRPA1 (0.45) | TRPA1ERCC5FEN1 | |
| SCHEMBL7167986 | 0.87 | TRPA1 (0.43) | TRPA1ERCC5FEN1PTGDR2 | |
| SCHEMBL6239555 | 0.84 | TRPA1 (0.62) | TRPA1POLBERCC5FEN1 | |
| SCHEMBL6514529 | 0.80 | TRPA1 (0.59) | TRPA1ERCC5FEN1MAPK8PTGDR2 | |
| SCHEMBL7097571 | 0.76 | TRPA1 (0.60) | TRPA1 | |
| SCHEMBL7152830 | 0.75 | TRPA1 (0.65) | TRPA1 | |
| SCHEMBL6233188 | 0.74 | TRPA1 (0.58) | TRPA1 | |
| SCHEMBL6235332 | 0.74 | TRPA1 (0.72) | TRPA1POLB | |
| SCHEMBL5957285 | 0.74 | TRPA1 (0.76) | TRPA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1362054-A1 | BICYCLIC PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS | Warner-Lambert Company LLC (US) | 2003-11-19 | — | — | EP | disclosed |
| WO-2002064599-A1 | BICYCLIC PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2002-08-22 | — | — | WO | disclosed |