Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM2B | Q8NHM5 | 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 | |
|---|---|---|---|---|
| SCHEMBL7039979 | 0.96 | PARP1 (0.50) | PARP1DRD2PARP2NPSR1POLB | |
| SCHEMBL7043633 | 0.91 | PARP1 (0.41) | PARP1ALDH1A1NPSR1 | |
| SCHEMBL7043857 | 0.90 | ALDH1A1 (0.43) | PARP1ALDH1A1NPSR1POLB | |
| SCHEMBL7041749 | 0.89 | ALDH1A1 (0.44) | PARP1ALDH1A1NPSR1POLBHSD17B10 | |
| SCHEMBL7047366 | 0.89 | NPSR1 (0.40) | PARP1ALDH1A1NPSR1POLB | |
| SCHEMBL7040070 | 0.89 | NPSR1 (0.40) | PARP1ALDH1A1NPSR1POLB | |
| SCHEMBL7042936 | 0.89 | MEN1 (0.38) | PARP1DRD2ALDH1A1L3MBTL1 | |
| SCHEMBL7043577 | 0.88 | ALDH1A1 (0.44) | PARP1ALDH1A1NPSR1POLBHSD17B10 | |
| SCHEMBL7043751 | 0.88 | DRD2 (0.39) | PARP1DRD2NPSR1 | |
| SCHEMBL7040708 | 0.88 | ALDH1A1 (0.39) | PARP1ALDH1A1NPSR1 |
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 |