Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.56 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 5/20 | 0.39 |
| ▸ | HRH1 | P35367 | 5/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL7042136 | 0.95 | PARP1 (0.51) | PARP1PARP2DRD2 | |
| SCHEMBL7043749 | 0.90 | ACHE (0.45) | PARP1DRD2 | |
| SCHEMBL7043338 | 0.87 | PARP1 (0.59) | PARP1PARP2DRD2HRH1SLC6A4 | |
| SCHEMBL7040941 | 0.85 | PARP1 (0.57) | PARP1PARP2DRD2HRH1 | |
| SCHEMBL7043682 | 0.85 | PARP1 (0.57) | PARP1PARP2DRD2HRH1 | |
| SCHEMBL5620344 | 0.85 | PARP1 (0.77) | PARP1PARP2 | |
| SCHEMBL7046731 | 0.85 | PARP1 (0.56) | PARP1PARP2DRD2HRH1 | |
| SCHEMBL7042613 | 0.84 | PARP1 (0.56) | PARP1PARP2DRD2HRH1 | |
| SCHEMBL7042083 | 0.84 | PARP1 (0.56) | PARP1PARP2DRD2HRH1 | |
| SCHEMBL7040495 | 0.83 | PARP1 (0.65) | PARP1PARP2DRD2 |
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 |