Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 13/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7043428 | 0.97 | PARP1 (0.41) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6875052 | 0.90 | PARP1 (0.49) | PARP1NPY5R | |
| SCHEMBL6869611 | 0.90 | PARP1 (0.43) | PARP1MAPT | |
| SCHEMBL6871167 | 0.89 | PARP1 (0.43) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6872714 | 0.89 | PARP1 (0.47) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6871454 | 0.88 | PARP1 (0.42) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6875540 | 0.88 | PARP1 (0.42) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6864442 | 0.88 | PARP1 (0.42) | PARP1ABCC1CYP3A4 | |
| SCHEMBL6864094 | 0.88 | PARP1 (0.52) | PARP1ABCC1 | |
| SCHEMBL6872890 | 0.88 | PARP1 (0.41) | PARP1ABCC1CYP3A4 |
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 |