Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.49 |
| ▸ | CHUK | O15111 | 2/20 | 0.49 |
| ▸ | TBK1 | Q9UHD2 | 7/20 | 0.45 |
| ▸ | JAK2 | O60674 | 5/20 | 0.45 |
| ▸ | JAK3 | P52333 | 2/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 3/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.41 |
| ▸ | BCR | P11274 | 2/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | PLK1 | P53350 | 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 | |
|---|---|---|---|---|
| SCHEMBL434303 | 0.89 | TBK1 (0.54) | IKBKBCHUKTBK1JAK2JAK3 | |
| SCHEMBL434757 | 0.89 | TBK1 (0.54) | IKBKBCHUKTBK1JAK2JAK3 | |
| SCHEMBL13279912 | 0.85 | TBK1 (0.52) | IKBKBCHUKTBK1JAK2IKBKE | |
| SCHEMBL13279693 | 0.83 | TBK1 (0.51) | IKBKBCHUKTBK1JAK2JAK3 | |
| SCHEMBL13279057 | 0.82 | TBK1 (0.49) | IKBKBCHUKTBK1JAK2IKBKE | |
| SCHEMBL434383 | 0.81 | TBK1 (0.49) | TBK1JAK2JAK3IKBKEHDAC1 | |
| SCHEMBL13279695 | 0.81 | TBK1 (0.50) | IKBKBCHUKTBK1JAK2JAK3 | |
| SCHEMBL436120 | 0.81 | JAK2 (0.49) | IKBKBTBK1JAK2JAK3MAP3K14 | |
| SCHEMBL13279523 | 0.80 | TBK1 (0.48) | IKBKBCHUKTBK1JAK2IKBKE | |
| SCHEMBL435695 | 0.79 | TBK1 (0.49) | TBK1JAK2JAK3IKBKEMAP3K14 |
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-2595964-A1 | PYRIMIDINE COMPOUNDS AS INHIBITORS OF PROTEIN KINASES IKK EPSILON AND/OR TBK-1, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Domainex Limited (GB) | 2013-05-29 | — | — | EP | claimed |
| WO-2012010826-A1 | PYRIMIDINE COMPOUNDS AS INHIBITORS OF PROTEIN KINASES IKK EPSILON AND/OR TBK-1, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DOMAINEX LIMITED (GB) | 2012-01-26 | — | — | WO | claimed |