Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 3/20 | 0.35 |
| ▸ | CTSC | P53634 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | PDE9A | O76083 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 4/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | VHL | P40337 | 1/20 | 0.32 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL4755648 | 0.77 | PIK3CA (0.35) | PIK3CAKDM5BPDE9APDE4ASYK | |
| SCHEMBL4753259 | 0.75 | PIK3CA (0.35) | PIK3CAKDM5BPDE9APDE4ASYK | |
| SCHEMBL4755652 | 0.68 | PDE4B (0.35) | JAK2PIK3CASYKJAK3JAK1 | |
| SCHEMBL4753233 | 0.66 | PDE9A (0.37) | PDE9A | |
| SCHEMBL13746012 | 0.64 | PIK3CA (0.36) | JAK2PIK3CAKDM5BPDE9APDE4A | |
| SCHEMBL13746104 | 0.62 | TYMS (0.38) | JAK2JAK3JAK1TYK2 | |
| SCHEMBL4756614 | 0.62 | KDM4E (0.33) | BRD4TYK2 | |
| SCHEMBL4756695 | 0.60 | HSD11B1 (0.39) | PDE9A | |
| SCHEMBL12630708 | 0.60 | CHEK1 (0.51) | JAK2PIK3CAKDM5BVHLSCN10A | |
| SCHEMBL8219055 | 0.60 | PBK (0.41) | JAK2JAK3JAK1TYK2 |
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-2008156607-A1 | SUBSTITUTED PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2008-12-24 | — | — | WO | claimed |