Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 16/20 | 0.57 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7421139 | 0.95 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL7413860 | 0.90 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL6864930 | 0.81 | PARP1 (0.65) | PARP1PARP2 | |
| SCHEMBL7411210 | 0.79 | PARP1 (0.37) | PARP1PARP2 | |
| SCHEMBL7410717 | 0.79 | PARP1 (0.39) | PARP1PARP2 | |
| SCHEMBL5621048 | 0.76 | PARP1 (0.88) | PARP1PARP2 | |
| SCHEMBL6873574 | 0.76 | PARP1 (0.73) | PARP1PARP2 | |
| Hydrochloric Acid SCHEMBL18614331 | 0.76 | PARP1 (0.86) | PARP1PARP2 | |
| SCHEMBL7410700 | 0.74 | PARP1 (0.57) | PARP1PARP2 | |
| SCHEMBL7417789 | 0.72 | PARP1 (0.63) | 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 |