Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL14764316 | 0.82 | TBK1 (0.67) | IKBKETBK1 | |
| SCHEMBL12801501 | 0.82 | KMO (0.47) | IKBKETBK1 | |
| SCHEMBL24904207 | 0.79 | IKBKE (0.46) | IKBKETBK1 | |
| SCHEMBL19175446 | 0.77 | SYK (0.44) | — | |
| SCHEMBL14771890 | 0.76 | IKBKE (0.75) | IKBKETBK1 | |
| SCHEMBL13467190 | 0.75 | IKBKE (0.56) | IKBKETBK1 | |
| SCHEMBL14771775 | 0.74 | IKBKE (0.76) | IKBKETBK1 | |
| SCHEMBL2596263 | 0.74 | PDE2A (0.41) | — | |
| SCHEMBL19527744 | 0.73 | SYK (0.47) | IKBKETBK1 | |
| SCHEMBL14771774 | 0.72 | IKBKE (0.77) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013034238-A1 | BENZONITRILE DERIVATIVES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2013-03-14 | — | — | WO | disclosed |