Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 6/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | FLT3 | P36888 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670362 | 0.89 | IRAK4 (0.39) | IRAK4SCN9ASLC5A1FYNPIM1 | |
| SCHEMBL19670168 | 0.88 | IRAK4 (0.43) | IRAK4GSK3BMAPK14SCN9ASLC5A1 | |
| SCHEMBL19670373 | 0.87 | KDR (0.41) | IRAK4GSK3BMAPK14SCN9ASLC5A1 | |
| SCHEMBL19365317 | 0.86 | GSK3B (0.39) | GSK3BMAPK14TRPV1PIM2 | |
| SCHEMBL19365613 | 0.86 | FAAH (0.40) | GSK3BTRPV1 | |
| SCHEMBL19365522 | 0.85 | KDM4E (0.39) | IRAK4HTR2CSLC5A1FYNTYRO3 | |
| SCHEMBL19670156 | 0.85 | PRMT5 (0.40) | GSK3BCYP1A2 | |
| SCHEMBL19670375 | 0.85 | TRPV1 (0.41) | GSK3BSCN9ACYP1A2HTR2AHTR2C | |
| SCHEMBL19670236 | 0.84 | DHODH (0.40) | IRAK4SCN9AHTR2CSLC5A1FYN | |
| SCHEMBL19365445 | 0.84 | TRPM8 (0.43) | GSK3BTRPV1KCNH2 |
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 |