Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.53 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.53 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5621431 | 0.83 | PARP1 (0.79) | PARP1PARP2 | |
| Hydrochloric Acid SCHEMBL7702646 | 0.82 | PARP1 (0.78) | PARP1PARP2 | |
| SCHEMBL6874947 | 0.80 | PARP1 (0.58) | PARP1PARP2 | |
| SCHEMBL4374769 | 0.79 | ALDH1A1 (0.53) | PARP1PARP2PDE10A | |
| SCHEMBL7413495 | 0.76 | PARP1 (0.58) | PARP1PARP2PDE10APTGS1PTGS2 | |
| SCHEMBL7215446 | 0.74 | PARP1 (0.61) | PARP1PARP2PDE10A | |
| SCHEMBL20463361 | 0.74 | PARP1 (0.46) | PARP1PARP2PDE10APTGS1PTGS2 | |
| SCHEMBL7460929 | 0.72 | PARP1 (0.55) | PARP1PTGS1PTGS2 | |
| SCHEMBL5620099 | 0.71 | PARP1 (0.76) | PARP1PARP2 | |
| SCHEMBL7524606 | 0.71 | ALDH1A1 (0.45) | PARP1PARP2PDE10APTGS1PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001082877-A2 | USE OF PARP INHIBITORS IN COSMETIC PREPARATIONS | BASF AKTIENGESELLSCHAFT (DE) | 2001-11-08 | — | — | WO | disclosed |
| 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 |