Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 13/20 | 1.00 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8359238 | 0.90 | PARP1 (1.00) | PARP1BAZ2BALDH1A1GAAKDR | |
| SCHEMBL14444052 | 0.86 | PARP1 (0.76) | PARP1BAZ2BALDH1A1GAA | |
| SCHEMBL8362901 | 0.86 | PARP1 (1.00) | PARP1NPC1ALDH1A1GAA | |
| SCHEMBL8359243 | 0.86 | PARP1 (0.75) | PARP1BAZ2BALDH1A1GAA | |
| SCHEMBL8359419 | 0.85 | PARP1 (0.74) | PARP1BAZ2BALDH1A1GAA | |
| SCHEMBL8359241 | 0.83 | PARP1 (0.71) | PARP1BAZ2BALDH1A1GAA | |
| SCHEMBL30029262 | 0.82 | PARP1 (0.70) | PARP1 | |
| SCHEMBL8359463 | 0.81 | PARP1 (1.00) | PARP1NPC1ALDH1A1 | |
| SCHEMBL8359249 | 0.80 | PARP1 (0.66) | PARP1BAZ2BALDH1A1GAA | |
| SCHEMBL8362899 | 0.78 | PARP1 (0.84) | PARP1BAZ2BALDH1A1GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7247641-B2 | Compounds, derivatives, compositions, preparation and uses | MGI GP, INC. (US) | 2007-07-24 | — | — | US | disclosed |
| US-7247641-B2 | Compounds, derivatives, compositions, preparation and uses | MGI GP, INC. (US) | 2007-07-24 | — | — | US | disclosed |
| WO-2003014121-A9 | COMPOUNDS, DERIVATIVES, COMPOSITIONS, PREPARATION AND USES | GUILFORD PHARM INC (US) | 2004-03-25 | — | — | WO | disclosed |
| WO-2003014121-A1 | COMPOUNDS, DERIVATIVES, COMPOSITIONS, PREPARATION AND USES | GUILFORD PHARMACEUTICALS INC. (US) | 2003-02-20 | — | — | WO | disclosed |