Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 13/20 | 0.34 |
| ▸ | GSK3B | P49841 | 10/20 | 0.34 |
| ▸ | WNT1 | P04628 | 8/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | CCR3 | P51677 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL19670332 | 0.93 | BRAF (0.41) | DYRK1AGSK3BWNT1CCR3BRAF | |
| SCHEMBL19670492 | 0.89 | DYRK1A (0.42) | DYRK1AGSK3BWNT1 | |
| SCHEMBL19670540 | 0.87 | DYRK1A (0.36) | DYRK1AGSK3BWNT1HTR2AHTR2C | |
| SCHEMBL19670434 | 0.87 | DYRK1A (0.34) | DYRK1AGSK3BWNT1CCR3BRAF | |
| SCHEMBL19670660 | 0.85 | HDAC3 (0.37) | DYRK1AGSK3BWNT1JAK3BRAF | |
| SCHEMBL16776404 | 0.85 | BRD4 (0.36) | DYRK1AGSK3BWNT1BRAFKDM4E | |
| SCHEMBL17618852 | 0.84 | KDM4E (0.35) | DYRK1AGSK3BWNT1CCR3KDM4E | |
| SCHEMBL19365369 | 0.82 | GSK3B (0.38) | DYRK1AGSK3BHTR2AHTR2CHTR2B | |
| SCHEMBL19865057 | 0.81 | RHOA (0.41) | DYRK1AGSK3BWNT1HTR2CCCR3 | |
| SCHEMBL19365752 | 0.80 | WNT3A (0.37) | DYRK1AGSK3BHTR2AHTR2CHTR2B |
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 |