Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 19/20 | 0.66 |
| ▸ | CHUK | O15111 | 6/20 | 0.66 |
| ▸ | BTK | Q06187 | 2/20 | 0.60 |
| ▸ | AURKA | O14965 | 1/20 | 0.60 |
| ▸ | FLT3 | P36888 | 1/20 | 0.60 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.60 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL552924 | 0.99 | IKBKB (0.67) | IKBKBCHUKBTKAURKAFLT3 | |
| Trifluoroacetic Acid SCHEMBL553789 | 0.94 | IKBKB (0.63) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL552110 | 0.92 | IKBKB (0.64) | IKBKBCHUKBTKAURKAFLT3 | |
| Trifluoroacetic Acid SCHEMBL553659 | 0.87 | IKBKB (0.60) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL552981 | 0.86 | IKBKB (0.70) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL551383 | 0.85 | IKBKB (0.70) | IKBKBCHUKBTKAURKAFLT3 | |
| Trifluoroacetic Acid SCHEMBL553269 | 0.82 | IKBKB (0.65) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL5035002 | 0.81 | IKBKB (0.73) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL4688439 | 0.80 | IKBKB (0.82) | IKBKBCHUKBTKAURKAFLT3 | |
| SCHEMBL551640 | 0.80 | IKBKB (0.73) | IKBKBCHUKBTKAURKAFLT3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007005534-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-01-11 | — | — | WO | disclosed |