Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 16/20 | 0.56 |
| ▸ | PARP2 | Q9UGN5 | 4/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5620530 | 0.99 | PARP1 (0.57) | PARP1PARP2THRBHTR1A | |
| SCHEMBL5621717 | 0.88 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL5619904 | 0.88 | PARP1 (0.67) | PARP1PARP2THRB | |
| SCHEMBL5621375 | 0.87 | PARP1 (0.57) | PARP1PARP2 | |
| SCHEMBL7041326 | 0.87 | PARP1 (0.43) | PARP1THRB | |
| SCHEMBL5620956 | 0.87 | PARP1 (0.57) | PARP1PARP2HTR1A | |
| SCHEMBL5621063 | 0.87 | PARP1 (0.57) | PARP1PARP2HTR1A | |
| SCHEMBL5620500 | 0.87 | PARP1 (0.59) | PARP1PARP2HTR1A | |
| SCHEMBL5622515 | 0.87 | PARP1 (0.61) | PARP1PARP2THRB | |
| SCHEMBL5622204 | 0.85 | PARP1 (0.55) | PARP1PARP2HTR1A |
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 |