Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 11/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.39 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17630410 | 0.86 | TBK1 (0.44) | GPR119TBK1JAK2NSD2 | |
| SCHEMBL17630409 | 0.86 | TBK1 (0.44) | GPR119TBK1JAK2NSD2 | |
| SCHEMBL20935188 | 0.84 | GPR119 (0.41) | GPR119TBK1JAK2NSD2RET | |
| SCHEMBL17645042 | 0.84 | TBK1 (0.43) | GPR119TBK1JAK2NSD2 | |
| SCHEMBL20934895 | 0.84 | TBK1 (0.37) | GPR119TBK1JAK2 | |
| SCHEMBL20918592 | 0.80 | TBK1 (0.40) | GPR119TBK1JAK2 | |
| SCHEMBL20934771 | 0.80 | TBK1 (0.40) | GPR119TBK1JAK2 | |
| SCHEMBL27040151 | 0.80 | NSD2 (0.42) | GPR119TBK1JAK2NSD2 | |
| SCHEMBL20709186 | 0.80 | NSD2 (0.42) | GPR119TBK1JAK2NSD2 | |
| SCHEMBL20918795 | 0.79 | GPR119 (0.42) | GPR119TBK1JAK2RET |
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 |