Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 10/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | TNK1 | Q13470 | 4/20 | 0.34 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.33 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14647192 | 0.83 | PARP1 (0.46) | TNKSPARP1TNK1TNK2PARP2 | |
| SCHEMBL14647191 | 0.77 | DRD4 (0.51) | TNKSPARP1TNK1PARP2DRD2 | |
| SCHEMBL15979574 | 0.76 | PARP1 (0.49) | TNKSPARP1KCNH2TNK1TNK2 | |
| SCHEMBL14647183 | 0.74 | PARP1 (0.46) | PARP1TNK1TNK2DRD2DRD4 | |
| SCHEMBL14647166 | 0.74 | PARP1 (0.49) | PARP1KCNH2TNK1TNK2PARP2 | |
| SCHEMBL14647226 | 0.73 | TNKS (0.43) | TNKSPARP1HTR3EHTR3BHTR1A | |
| SCHEMBL14647187 | 0.72 | DRD4 (0.43) | PARP1HTR6DRD2DRD4DRD3 | |
| SCHEMBL14647213 | 0.72 | MAPK1 (0.49) | PARP1HTR6DRD2DRD4DRD3 | |
| SCHEMBL14647239 | 0.70 | KDM4E (0.46) | DRD2DRD4DRD3HTR1A | |
| SCHEMBL15979572 | 0.70 | DRD2 (0.47) | TNKSPARP1DRD2DRD4HTR1A |
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-2733144-B1 | NOVEL COMPOUND HAVING PARP INHIBITORY ACTIVITY | SANTEN PHARMACEUTICAL CO LTD (JP) | 2016-01-06 | — | — | EP | disclosed |