Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADA | P00813 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | MTOR | P42345 | 3/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.41 |
| ▸ | ATR | Q13535 | 2/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.37 |
| ▸ | PDE9A | O76083 | 8/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.36 |
| ▸ | PDE5A | O76074 | 2/20 | 0.36 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1128374 | 0.84 | PIK3CA (0.56) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL27651255 | 0.83 | CYP3A4 (0.45) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL27630983 | 0.79 | EGFR (0.51) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL27852877 | 0.77 | CYP3A4 (0.38) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL27773611 | 0.77 | MTOR (0.54) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL1128398 | 0.74 | NR3C1 (0.57) | PIK3CAMTORPIK3CGATRAURKB | |
| Tert-Butyl Formate SCHEMBL28794668 | 0.73 | ADA (0.39) | ADAPIK3CAMTORPIK3CGATR | |
| SCHEMBL28791755 | 0.73 | EGFR (0.45) | NR3C1CYP3A4 | |
| SCHEMBL27797758 | 0.72 | ALOX15 (0.34) | PIK3CAMTORPIK3CGATRAURKB | |
| SCHEMBL4356710 | 0.72 | NR3C1 (0.54) | PIK3CAMTORPIK3CGATRAURKB |
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 |
|---|---|---|---|---|---|---|---|
| CN-102036991-A | GPR119 receptor agonists | HOFFMANN LA ROCHE | 2011-04-27 | — | — | CN | disclosed |