Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 19/20 | 0.48 |
| ▸ | PARP2 | Q9UGN5 | 6/20 | 0.42 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7043785 | 0.88 | TAAR1 (0.37) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5621927 | 0.84 | PARP1 (0.54) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5621129 | 0.83 | PARP1 (0.53) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5620495 | 0.83 | PARP1 (0.53) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5619993 | 0.82 | PARP1 (0.53) | PARP1PARP2PARP3 | |
| SCHEMBL5621827 | 0.82 | PARP1 (0.49) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5620980 | 0.82 | PARP1 (0.49) | PARP1PARP2PARP3TAAR1 | |
| SCHEMBL5621834 | 0.82 | PARP1 (0.52) | PARP1PARP2PARP3 | |
| SCHEMBL7700402 | 0.81 | PARP1 (0.49) | PARP1PARP2PARP3 | |
| SCHEMBL7705631 | 0.80 | PARP1 (0.47) | PARP1PARP2PARP3TAAR1 |
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-6448271-B1 | SUCH AS 2-(PIPERIDIN-4-YL)BENZIMIDAZOLE-4-CARBOXAMIDE; INHIBITORS OF ENZYME POLY(ADP-RIBOSE)POLYMERASE; IMPROVED WATER SOLUBILITY | BASF AKTIENGESELLSCHAFT (DE) | 2002-09-10 | — | — | US | disclosed |