Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKE | Q14164 | 17/20 | 0.49 |
| ▸ | TBK1 | Q9UHD2 | 17/20 | 0.49 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1667928 | 0.85 | TBK1 (0.51) | IKBKETBK1AAK1 | |
| SCHEMBL20918742 | 0.85 | AAK1 (0.43) | IKBKETBK1AAK1 | |
| SCHEMBL1669851 | 0.85 | TBK1 (0.56) | IKBKETBK1AAK1 | |
| SCHEMBL1667504 | 0.83 | KMO (0.49) | IKBKETBK1AAK1 | |
| SCHEMBL1667272 | 0.83 | TBK1 (0.64) | IKBKETBK1 | |
| SCHEMBL13467205 | 0.81 | TBK1 (0.57) | IKBKETBK1AAK1 | |
| SCHEMBL12522330 | 0.80 | TBK1 (0.46) | IKBKETBK1AAK1 | |
| SCHEMBL13280173 | 0.80 | TBK1 (0.46) | IKBKETBK1AAK1 | |
| SCHEMBL20918744 | 0.78 | TBK1 (0.52) | IKBKETBK1AAK1 | |
| SCHEMBL28408079 | 0.78 | TBK1 (0.52) | IKBKETBK1AAK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2488503-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | Myrexis, Inc. (US) | 2012-08-22 | — | — | EP | disclosed |
| WO-2011046970-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | MYREXIS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |