Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.57 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.47 |
| ▸ | SLC6A9 | P48067 | 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 | |
|---|---|---|---|---|
| SCHEMBL6656957 | 0.85 | ADAM17 (0.47) | PTGS2ADAM17 | |
| SCHEMBL6662474 | 0.84 | PTGS2 (0.42) | PTGS2ADAM17 | |
| SCHEMBL6656710 | 0.84 | PTGS2 (0.42) | PTGS2ADAM17 | |
| SCHEMBL6655284 | 0.83 | ADAM17 (0.51) | ADAM17 | |
| SCHEMBL7324048 | 0.81 | ADAM17 (0.42) | PTGS2ADAM17 | |
| SCHEMBL6660831 | 0.81 | ADAM17 (0.42) | PTGS2ADAM17 | |
| SCHEMBL6654867 | 0.81 | ADAM17 (0.44) | PTGS2ADAM17 | |
| SCHEMBL6658035 | 0.80 | PTGS2 (0.39) | PTGS2ADAM17 | |
| SCHEMBL3984466 | 0.79 | SLC6A9 (0.54) | PTGS2SLC6A9 | |
| SCHEMBL6654465 | 0.79 | ADAM17 (0.46) | ADAM17 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1147080-B1 | ALKYNYL CONTAINING HYDROXAMIC ACID COMPOUNDS AS TACE INHIBITORS | WYETH CORP (US) | 2004-07-21 | — | — | EP | disclosed |