Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.38 |
| ▸ | HTR1F | P30939 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7040728 | 0.94 | PARP1 (0.51) | PARP1PARP2HTR2ABAZ2A | |
| SCHEMBL7046800 | 0.94 | PARP1 (0.47) | PARP1PARP2 | |
| SCHEMBL7045124 | 0.85 | PARP1 (0.53) | PARP1PARP2 | |
| SCHEMBL7040921 | 0.84 | PARP1 (0.52) | PARP1PARP2 | |
| SCHEMBL5620854 | 0.84 | PARP1 (0.64) | PARP1PARP2 | |
| SCHEMBL7042400 | 0.80 | PARP1 (0.47) | PARP1PARP2 | |
| SCHEMBL6869625 | 0.79 | PARP1 (0.69) | PARP1PARP2 | |
| SCHEMBL7411360 | 0.79 | PARP1 (0.56) | PARP1PARP2 | |
| SCHEMBL7042529 | 0.79 | PARP1 (0.54) | PARP1PARP2 | |
| SCHEMBL7038859 | 0.78 | PARP1 (0.51) | 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 |