Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.57 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5620956 | 0.92 | PARP1 (0.57) | PARP1PARP2HTR1A | |
| SCHEMBL5620500 | 0.92 | PARP1 (0.59) | PARP1PARP2HTR1A | |
| SCHEMBL5622204 | 0.90 | PARP1 (0.55) | PARP1PARP2HTR1A | |
| SCHEMBL5621717 | 0.90 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL5621981 | 0.90 | PARP1 (0.55) | PARP1PARP2HTR1A | |
| SCHEMBL7705473 | 0.87 | PARP1 (0.56) | PARP1PARP2HTR1A | |
| SCHEMBL5620530 | 0.86 | PARP1 (0.57) | PARP1PARP2HTR1A | |
| SCHEMBL7041865 | 0.86 | PARP1 (0.43) | PARP1HTR1A | |
| SCHEMBL5620538 | 0.84 | PARP1 (0.56) | PARP1PARP2HTR1A | |
| SCHEMBL5621929 | 0.83 | PARP1 (0.64) | 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 |
|---|---|---|---|---|---|---|---|
| US-RE39608-E1 | Substituted benzimidazoles and their use as PARP inhibitors | ABBOTT GMBH & CO. KG (DE) | 2007-05-01 | — | — | US | disclosed |
| 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 |