Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 11/20 | 0.36 |
| ▸ | WNT1 | P04628 | 9/20 | 0.36 |
| ▸ | GSK3B | P49841 | 9/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 2/20 | 0.33 |
| ▸ | CLK3 | P49761 | 2/20 | 0.33 |
| ▸ | WNT3A | P56704 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670328 | 0.90 | DYRK1A (0.44) | DYRK1AWNT1GSK3BADORA2AADORA2B | |
| SCHEMBL19670659 | 0.87 | DYRK1A (0.34) | DYRK1AWNT1GSK3BBRAFCLK2 | |
| SCHEMBL19365752 | 0.86 | WNT3A (0.37) | DYRK1AGSK3BWNT3AGRM5CYP1A2 | |
| SCHEMBL16776425 | 0.86 | BRD4 (0.35) | DYRK1AWNT1GSK3BADORA2AADORA2B | |
| SCHEMBL17618870 | 0.85 | DYRK1A (0.35) | DYRK1AWNT1GSK3BADORA2AADORA2B | |
| SCHEMBL19670660 | 0.85 | HDAC3 (0.37) | DYRK1AWNT1GSK3BBRAFJAK3 | |
| SCHEMBL19365620 | 0.84 | HTR2C (0.43) | WNT3ACYP1A2HTR2AHTR2CHTR2B | |
| SCHEMBL19670405 | 0.83 | BRAF (0.40) | DYRK1AWNT1GSK3BBRAFWNT3A | |
| SCHEMBL19670492 | 0.82 | DYRK1A (0.42) | DYRK1AWNT1GSK3B | |
| SCHEMBL19670332 | 0.81 | BRAF (0.41) | DYRK1AWNT1GSK3BBRAF |
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 |