Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7708432 | 0.97 | PARP1 (0.45) | PARP1PARP2THRB | |
| SCHEMBL7041774 | 0.88 | SMN1; SMN2 (0.37) | PARP1THRBNPC1 | |
| SCHEMBL7705477 | 0.86 | PARP1 (0.54) | PARP1PARP2THRB | |
| SCHEMBL5622228 | 0.86 | PARP1 (0.51) | PARP1PARP2THRB | |
| SCHEMBL7040063 | 0.85 | SMN1; SMN2 (0.36) | PARP1THRBNPC1 | |
| SCHEMBL5621867 | 0.84 | PARP1 (0.44) | PARP1PARP2 | |
| SCHEMBL5621352 | 0.84 | PARP1 (0.52) | PARP1PARP2 | |
| SCHEMBL5620548 | 0.83 | PARP1 (0.43) | PARP1PARP2 | |
| SCHEMBL5621918 | 0.83 | PARP1 (0.44) | PARP1PARP2 | |
| SCHEMBL5620405 | 0.82 | PARP1 (0.43) | PARP1 |
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 |