Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 18/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6782559 | 0.94 | PARP1 (0.44) | PARP1PARP2ALDH1A1 | |
| SCHEMBL6781020 | 0.89 | PARP1 (0.48) | PARP1PARP2 | |
| SCHEMBL6777884 | 0.89 | PARP1 (0.43) | PARP1PARP2ALDH1A1 | |
| SCHEMBL6782909 | 0.86 | PARP1 (0.43) | PARP1PARP2 | |
| SCHEMBL6786603 | 0.84 | PARP1 (0.59) | PARP1PARP2 | |
| SCHEMBL6787134 | 0.82 | PARP1 (0.49) | PARP1PARP2 | |
| SCHEMBL6785917 | 0.82 | PARP1 (0.49) | PARP1PARP2 | |
| SCHEMBL6781757 | 0.82 | PARP1 (0.49) | PARP1PARP2 | |
| SCHEMBL5072046 | 0.81 | PARP1 (0.45) | PARP1PARP2 | |
| SCHEMBL5074011 | 0.81 | PARP1 (0.55) | 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 |
|---|---|---|---|---|---|---|---|
| US-6737421-B1 | 4-CARBOXYAMIDO SUBSTITUTED; NEURODEGENERATIVE DISEASES; NEURONAL DAMAGE | ABBOTT GMBH & CO. KG (DE) | 2004-05-18 | — | — | US | disclosed |