Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.61 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.60 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | HTR1F | P30939 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7409701 | 0.94 | PARP1 (0.61) | PARP1PARP2TLR9TLR8TLR7 | |
| SCHEMBL7410700 | 0.87 | PARP1 (0.57) | PARP1PARP2DRD2 | |
| SCHEMBL7409815 | 0.82 | PARP1 (0.60) | PARP1PARP2TLR9TLR8TLR7 | |
| SCHEMBL7409390 | 0.79 | PARP1 (0.58) | PARP1PARP2DRD2 | |
| SCHEMBL7415524 | 0.78 | TSHR (0.39) | PARP1PARP2DRD2 | |
| SCHEMBL423949 | 0.75 | PARP1 (1.00) | PARP1PARP2 | |
| SCHEMBL7409877 | 0.73 | PARP1 (0.55) | PARP1PARP2HTR1F | |
| SCHEMBL6865071 | 0.73 | PARP1 (0.73) | PARP1PARP2 | |
| SCHEMBL7413860 | 0.72 | PARP1 (0.60) | PARP1PARP2TLR9TLR8TLR7 | |
| Succinic Acid SCHEMBL29396818 | 0.71 | PARP1 (0.90) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1133477-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000032579-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-08 | — | — | WO | disclosed |