Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 6/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 4/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.32 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | AGXT | P21549 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4123059 | 0.85 | PDE5A (0.34) | TTKHCRTR1HCRTR2ATMPIK3C3 | |
| SCHEMBL4128912 | 0.85 | PDE5A (0.41) | — | |
| SCHEMBL4142910 | 0.81 | HSP90AA1 (0.37) | HSP90AA1HSP90AB1TTKPRKDCAGXT | |
| SCHEMBL4130410 | 0.79 | PARP1 (0.34) | ATMPARP1 | |
| SCHEMBL4133677 | 0.78 | TPH1 (0.33) | HCRTR1HCRTR2ATMPIK3C3METAP2 | |
| SCHEMBL4128842 | 0.78 | KDM4E (0.35) | HCRTR1HCRTR2ATMPIK3C3PRKDC | |
| SCHEMBL8032549 | 0.77 | PDE5A (0.36) | HTR2CTLR7 | |
| SCHEMBL8027507 | 0.75 | PDE10A (0.38) | ATM | |
| SCHEMBL4136646 | 0.74 | PDE5A (0.43) | — | |
| SCHEMBL8037857 | 0.74 | PDE5A (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009071706-A1 | PYRAZOLEPYRIMIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS NV (BE) | 2009-06-11 | — | — | WO | disclosed |