Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.58 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.58 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.58 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 4/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | GHSR | Q92847 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2085106 | 0.88 | PDE4A (0.56) | PDE4APDE4BPDE4CPDE4DMTOR | |
| SCHEMBL2086343 | 0.88 | PDE4A (0.44) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL14852792 | 0.81 | PDE4A (0.47) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL2085527 | 0.81 | PDE4A (0.69) | PDE4APDE4BPDE4CPDE4DMTOR | |
| SCHEMBL1573242 | 0.80 | PTGS2 (0.50) | PTGS2PTGS1 | |
| SCHEMBL14852793 | 0.79 | BCL2 (0.47) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL17970604 | 0.79 | PDE4A (0.54) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL12936298 | 0.79 | PTGS2 (0.47) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL2083337 | 0.79 | PDE4A (0.54) | PDE4APDE4BPDE4CPDE4DPTGS2 | |
| SCHEMBL12936302 | 0.78 | PDE4A (0.53) | PDE4APDE4BPDE4CPDE4DPTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8420653-B2 | Pyrimidine compounds and their uses | ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) | 2013-04-16 | — | — | US | claimed |
| EP-2245017-A2 | NOVEL HETEROCYCLES | Orchid Research Laboratories Limited (IN) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009095773-A2 | NOVEL HETEROCYCLES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2009-08-06 | — | — | WO | disclosed |