Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | PAK4 | O96013 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24201441 | 0.86 | GAA (0.36) | LMNAMAPTMEN1ALDH1A1TP53 | |
| SCHEMBL22672604 | 0.76 | TBK1 (0.44) | TBK1IKBKEPTPN1LMNAMAPT | |
| SCHEMBL21649228 | 0.76 | GRM4 (0.42) | TBK1IKBKEPTPN1KIF11LMNA | |
| SCHEMBL10216187 | 0.76 | CHRNB2 (0.41) | TBK1IKBKEKIF11LMNAMAPT | |
| SCHEMBL18687390 | 0.75 | TRPA1 (0.40) | TBK1IKBKEKIF11LMNAMAPT | |
| SCHEMBL23478674 | 0.75 | TBK1 (0.36) | TBK1IKBKETNKSPARP1TNKS2 | |
| SCHEMBL12546215 | 0.75 | TBK1 (0.45) | TBK1IKBKEKIF11LMNAMAPT | |
| SCHEMBL20884969 | 0.72 | TBK1 (0.34) | TBK1IKBKEPTPN1KIF11LMNA | |
| SCHEMBL2706167 | 0.67 | BCHE (0.45) | TBK1IKBKETNKSPARP1TNKS2 | |
| SCHEMBL12974388 | 0.66 | TRPA1 (0.41) | TBK1PTPN1LMNAMAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3353176-B1 | BICYCLIC COMPOUNDS AS ATX INHIBITORS | HOFFMANN LA ROCHE (CH) | 2022-01-19 | — | — | EP | disclosed |