Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | CHUK | O15111 | 1/20 | 0.31 |
| ▸ | IKBKG | Q9Y6K9 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4494160 | 0.89 | IKBKB (0.33) | IKBKBCHUKIKBKGMAPK1 | |
| SCHEMBL13638661 | 0.88 | RPS6KB2 (0.38) | — | |
| SCHEMBL13638303 | 0.86 | IKBKB (0.43) | IKBKBCHUKIKBKG | |
| SCHEMBL13638505 | 0.81 | JUN (0.31) | MAPK1 | |
| SCHEMBL3471753 | 0.79 | IKBKB (0.32) | IKBKBCHUKIKBKG | |
| SCHEMBL13638415 | 0.77 | CDK7 (0.34) | IKBKBCHUKIKBKG | |
| SCHEMBL4482123 | 0.77 | RPS6KB2 (0.41) | MAPK1 | |
| SCHEMBL13638292 | 0.76 | KDR (0.37) | IKBKBCHUKIKBKG | |
| SCHEMBL13638316 | 0.76 | KCNH2 (0.44) | MAPK1 | |
| SCHEMBL13638306 | 0.76 | IKBKB (0.34) | IKBKBCHUKIKBKG |
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 |
|---|---|---|---|---|---|---|---|
| US-7615562-B2 | Such as 2-methyl-4-{5-[2-(2,2,6,6-tetramethyl-piperidin-4-ylamino)-pyrimidin-4-yl]-thiophen-2-yl}-butan-2-ol; tumor necrosis factor inhibitors; immunosuppressants; antiinflammatory agents | NOVARTIS AG (CH) | 2009-11-10 | — | — | US | disclosed |