Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 15/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1128606 | 0.90 | CYP3A4 (0.78) | CYP3A4CYP2C9GPR119 | |
| SCHEMBL1128382 | 0.90 | CYP3A4 (0.63) | CYP3A4CYP2C9GPR119KCNH2 | |
| SCHEMBL1128845 | 0.86 | CYP3A4 (0.55) | CYP3A4CYP2C9GPR119KCNH2 | |
| SCHEMBL2019784 | 0.86 | CYP3A4 (0.79) | CYP3A4CYP2C9GPR119KCNH2 | |
| SCHEMBL1129187 | 0.84 | CYP3A4 (0.61) | CYP3A4CYP2C9GPR119KCNH2 | |
| SCHEMBL4356654 | 0.84 | CYP3A4 (0.51) | CYP3A4CYP2C9GPR119BTK | |
| SCHEMBL4354583 | 0.84 | CYP3A4 (0.60) | CYP3A4CYP2C9KCNH2BTK | |
| SCHEMBL4355794 | 0.82 | CYP3A4 (0.57) | CYP3A4CYP2C9GPR119BTK | |
| SCHEMBL4350405 | 0.82 | CYP3A4 (0.52) | CYP3A4CYP2C9KCNH2BTK | |
| SCHEMBL4328580 | 0.82 | CYP3A4 (0.51) | CYP3A4CYP2C9GPR119KCNH2BTK |
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-2009141238-A1 | GPR119 RECEPTOR AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-11-26 | — | — | WO | disclosed |