Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 5/20 | 0.47 |
| ▸ | IKBKE | Q14164 | 14/20 | 0.45 |
| ▸ | TBK1 | Q9UHD2 | 14/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24904207 | 0.88 | IKBKE (0.46) | KMOIKBKETBK1PIK3CA | |
| SCHEMBL1667272 | 0.83 | TBK1 (0.64) | IKBKETBK1 | |
| SCHEMBL14771771 | 0.82 | IKBKE (0.46) | IKBKETBK1 | |
| SCHEMBL12801198 | 0.81 | SYK (0.42) | IKBKETBK1PIK3CA | |
| SCHEMBL13467190 | 0.80 | IKBKE (0.56) | IKBKETBK1 | |
| SCHEMBL12801672 | 0.80 | TBK1 (0.57) | IKBKETBK1 | |
| SCHEMBL12801120 | 0.80 | IKBKE (0.57) | IKBKETBK1 | |
| SCHEMBL12801135 | 0.78 | IKBKE (0.56) | IKBKETBK1 | |
| SCHEMBL12801392 | 0.78 | IKBKE (0.56) | IKBKETBK1 | |
| SCHEMBL12801583 | 0.78 | IKBKE (0.56) | IKBKETBK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012142329-A1 | COMPOSITIONS AND THERAPEUTIC USES OF IKK-RELATED KINASE EPSILON AND TANKBINDING KINASE 1 INHIBITORS | MYREXIS, INC. (US) | 2012-10-18 | — | — | WO | disclosed |
| WO-2011046970-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | MYREXIS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |