Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.48 |
| ▸ | IKBKB | O14920 | 4/20 | 0.48 |
| ▸ | CHUK | O15111 | 3/20 | 0.48 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.47 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | PRKCI | P41743 | 2/20 | 0.45 |
| ▸ | AXL | P30530 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 3/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | TYK2 | P29597 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.43 |
| ▸ | CIT | O14578 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | PRKCB | P05771 | 1/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.43 |
| ▸ | MARK3 | P27448 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30009857 | 0.80 | JAK1 (0.57) | IKBKBCHUKPTK2NUDT1ROCK1 | |
| SCHEMBL30009803 | 0.78 | IKBKB (0.55) | IKBKBCHUKROCK1PRKCIJAK1 | |
| SCHEMBL30009511 | 0.78 | CIT (0.59) | IKBKBCHUKROCK1PRKCIJAK1 | |
| SCHEMBL30009181 | 0.78 | CIT (0.50) | IKBKBCHUKNUDT1ROCK1JAK1 | |
| SCHEMBL3093132 | 0.78 | PRKCI (0.55) | TNNI3KIKBKBCHUKPTK2NUDT1 | |
| SCHEMBL30009525 | 0.77 | IKBKB (0.76) | IKBKBCHUKPTK2ROCK1JAK2 | |
| SCHEMBL30009421 | 0.77 | JAK1 (0.46) | IKBKBCHUKNUDT1ROCK1PRKCI | |
| SCHEMBL30009164 | 0.77 | JAK1 (0.59) | IKBKBCHUKNUDT1JAK1CIT | |
| SCHEMBL30009844 | 0.77 | JAK1 (0.64) | IKBKBCHUKROCK1JAK1CIT | |
| SCHEMBL30009186 | 0.74 | JAK1 (0.60) | IKBKBCHUKPTK2NUDT1ROCK1 |
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-7943616-B2 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2011-05-17 | — | — | US | disclosed |