Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.51 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | PIM1 | P11309 | 3/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.37 |
| ▸ | INSR | P06213 | 2/20 | 0.37 |
| ▸ | CSF1R | P07333 | 2/20 | 0.37 |
| ▸ | CLK2 | P49760 | 2/20 | 0.37 |
| ▸ | IRAK1 | P51617 | 2/20 | 0.37 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.37 |
| ▸ | MAP4K5 | Q9Y4K4 | 2/20 | 0.37 |
| ▸ | FLT4 | P35916 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7043271 | 0.94 | PARP1 (0.49) | PARP1HTR2APARP2BAZ2A | |
| SCHEMBL7046800 | 0.88 | PARP1 (0.47) | PARP1PARP2 | |
| SCHEMBL7042529 | 0.85 | PARP1 (0.54) | PARP1PIM1MAP4K4INSRCSF1R | |
| SCHEMBL5620132 | 0.85 | PARP1 (0.65) | PARP1PIM1MAP4K4INSRCSF1R | |
| SCHEMBL7040577 | 0.85 | PARP1 (0.54) | PARP1HTR2APIM1MAP4K4INSR | |
| SCHEMBL7045166 | 0.81 | PARP1 (0.50) | PARP1PIM1MAP4K4INSRCSF1R | |
| SCHEMBL6864453 | 0.80 | PARP1 (0.71) | PARP1PIM1MAP4K4INSRCSF1R | |
| SCHEMBL7045124 | 0.79 | PARP1 (0.53) | PARP1PARP2 | |
| SCHEMBL7040921 | 0.78 | PARP1 (0.52) | PARP1PIM1MAP4K4INSRCSF1R | |
| SCHEMBL5620854 | 0.78 | PARP1 (0.64) | PARP1PARP2 |
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-1133477-B1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2004-02-18 | — | — | EP | disclosed |