Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | NPY1R | P25929 | 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 | |
|---|---|---|---|---|
| SCHEMBL7045615 | 0.94 | PARP1 (0.51) | PARP1PARP2KCNH2HTR2BHRH3 | |
| SCHEMBL7040671 | 0.87 | PARP1 (0.50) | PARP1PARP2KCNH2HTR2BHSD11B1 | |
| SCHEMBL7040201 | 0.85 | PARP1 (0.54) | PARP1PARP2HTR2BHSD11B1 | |
| SCHEMBL7038340 | 0.84 | PARP1 (0.48) | PARP1HTR2BHSD11B1 | |
| SCHEMBL5620547 | 0.84 | PARP1 (0.66) | PARP1PARP2 | |
| SCHEMBL7040495 | 0.84 | PARP1 (0.65) | PARP1PARP2 | |
| SCHEMBL7044945 | 0.82 | PARP1 (0.45) | PARP1HTR2BHSD11B1 | |
| SCHEMBL7041082 | 0.81 | PARP1 (0.52) | PARP1HTR2B | |
| SCHEMBL7042003 | 0.80 | PARP1 (0.48) | PARP1PARP2HTR2B | |
| SCHEMBL7044098 | 0.80 | PARP1 (0.38) | PARP1PARP2HSD11B1HRH3 |
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 |