Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 8/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19365424 | 0.92 | ABL1 (0.40) | GRM5CYP3A4CYP1A2CYP2C9FGFR4 | |
| SCHEMBL19365563 | 0.86 | KMT2A (0.37) | GRM5IRAK4PTGES | |
| SCHEMBL19670452 | 0.83 | GRM5 (0.38) | GRM5FGFR4JAK2NTRK1 | |
| SCHEMBL19365345 | 0.82 | KDM1A (0.39) | FGFR4JAK2HCRTR1 | |
| SCHEMBL20632596 | 0.82 | ABL1 (0.36) | GRM5CYP3A4CYP1A2CYP2C9JAK2 | |
| SCHEMBL19365723 | 0.81 | DYRK1A (0.38) | GRM5CYP3A4ABL1CHRNB2CHRNA6 | |
| SCHEMBL19364893 | 0.79 | CYP1A2 (0.39) | GRM5CYP3A4CYP1A2CYP2C9FGFR4 | |
| SCHEMBL17618628 | 0.79 | CYP3A4 (0.37) | GRM5CYP3A4CYP1A2CYP2C9FGFR4 | |
| SCHEMBL19670347 | 0.79 | CRHR1 (0.37) | IRAK4PTGES | |
| SCHEMBL17618541 | 0.78 | SCD (0.38) | GRM5CYP3A4CYP1A2CYP2C9FGFR4 |
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 |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |