Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | NEK4 | P51957 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2772730 | 0.79 | QPCT (0.47) | TLR7ALDH1A1KDM4EPARGHPGD | |
| SCHEMBL24570158 | 0.78 | PARG (0.49) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL24570832 | 0.76 | PARG (0.48) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL2759479 | 0.74 | ERCC1 (0.58) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL6510464 | 0.73 | ALDH1A1 (0.59) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL26606602 | 0.73 | ERCC1 (0.45) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL10272797 | 0.69 | ERCC1 (0.49) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL24570735 | 0.68 | ADRA1B (0.42) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL6518727 | 0.68 | FEN1 (0.47) | ERCC1ERCC5FEN1ERCC4ADRA1B | |
| SCHEMBL2733484 | 0.68 | ERCC1 (0.50) | ERCC1ERCC5FEN1ERCC4ALDH1A1 |
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-2253630-A1 | Heterocyclic compound and use thereof | Takeda Pharmaceutical Company Limited (JP) | 2010-11-24 | — | — | EP | disclosed |