Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 19/20 | 0.46 |
| ▸ | IKBKE | Q14164 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 13/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL24904172 | 0.93 | TBK1 (0.52) | TBK1IKBKEJAK2 | |
| SCHEMBL20934839 | 0.86 | TBK1 (0.59) | TBK1IKBKEJAK2 | |
| SCHEMBL20935193 | 0.85 | TBK1 (0.46) | TBK1IKBKEJAK2 | |
| SCHEMBL24904182 | 0.85 | TBK1 (0.51) | TBK1IKBKEJAK2 | |
| SCHEMBL20935203 | 0.84 | TBK1 (0.63) | TBK1IKBKEJAK2 | |
| SCHEMBL20935204 | 0.84 | TBK1 (0.63) | TBK1IKBKEJAK2 | |
| SCHEMBL20934764 | 0.84 | TBK1 (0.49) | TBK1IKBKEJAK2 | |
| SCHEMBL24904181 | 0.83 | TBK1 (0.52) | TBK1IKBKEJAK2 | |
| SCHEMBL20935147 | 0.81 | TBK1 (0.67) | TBK1IKBKEJAK2 | |
| SCHEMBL24904170 | 0.81 | TBK1 (0.56) | TBK1IKBKEJAK2 |
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-2019079373-A1 | PYRIMIDINE TBK/IKKε INHIBITOR COMPOUNDS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2019-04-25 | — | — | WO | disclosed |