Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.45 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7042195 | 0.97 | PARP1 (0.42) | PARP1THRBDRD2DRD3KDM2B | |
| SCHEMBL7043346 | 0.96 | PARP1 (0.50) | PARP1PARP2THRBDRD2TERT | |
| SCHEMBL7043782 | 0.89 | PARP1 (0.52) | PARP1PARP2DRD2DRD3KDM2B | |
| SCHEMBL7042142 | 0.88 | PARP1 (0.52) | PARP1PARP2DRD2DRD3SMN1; SMN2 | |
| SCHEMBL7041326 | 0.88 | PARP1 (0.43) | PARP1THRBDRD2TERTSMN1; SMN2 | |
| SCHEMBL7041579 | 0.88 | JAK2 (0.40) | PARP1THRBTERTSMN1; SMN2CYP2D6 | |
| SCHEMBL5622515 | 0.87 | PARP1 (0.61) | PARP1PARP2THRBDRD2DRD3 | |
| SCHEMBL7043437 | 0.86 | PARP1 (0.49) | PARP1PARP2DRD2DRD3KDM2B | |
| SCHEMBL7043890 | 0.86 | PARP1 (0.35) | PARP1THRBTERTSMN1; SMN2CYP2D6 | |
| SCHEMBL7043532 | 0.85 | PARP1 (0.48) | PARP1PARP2DRD2DRD3KDM2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1133477-B1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2004-02-18 | — | — | EP | disclosed |