Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 18/20 | 0.56 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869195 | 0.95 | PARP1 (0.63) | PARP1PARP2 | |
| SCHEMBL6870252 | 0.90 | PARP1 (0.57) | PARP1PARP2 | |
| SCHEMBL6864930 | 0.87 | PARP1 (0.65) | PARP1PARP2 | |
| SCHEMBL6872986 | 0.87 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL6872713 | 0.87 | PARP1 (0.64) | PARP1PARP2 | |
| SCHEMBL5620527 | 0.87 | PARP1 (0.75) | PARP1PARP2 | |
| SCHEMBL6869294 | 0.86 | PARP1 (0.63) | PARP1PARP2 | |
| SCHEMBL6875383 | 0.85 | PARP1 (0.54) | PARP1PARP2 | |
| SCHEMBL6869898 | 0.84 | PARP1 (0.61) | PARP1PARP2 | |
| SCHEMBL6873552 | 0.84 | PARP1 (0.60) | 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 |