Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | UGCG | Q16739 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 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 | |
|---|---|---|---|---|
| SCHEMBL4722930 | 0.92 | PDE4A (0.37) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL4723325 | 0.88 | NOTUM (0.36) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL4722304 | 0.88 | NOTUM (0.36) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL4722947 | 0.88 | MAPT (0.39) | KDM4EALDH1A1GAAMAPTALOX15 | |
| SCHEMBL4722182 | 0.88 | NOTUM (0.36) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL4724510 | 0.88 | PDE4A (0.36) | PDE4APDE4BPDE4CPDE4DDPP4 | |
| SCHEMBL4724513 | 0.88 | PDE4A (0.36) | PDE4APDE4BPDE4CPDE4DDPP4 | |
| SCHEMBL4719498 | 0.88 | P2RX7 (0.38) | PDE4APDE4BPDE4CPDE4DUGCG | |
| SCHEMBL4722544 | 0.88 | PDE4A (0.36) | PDE4APDE4BPDE4CPDE4DGAA | |
| SCHEMBL4719501 | 0.88 | P2RX7 (0.38) | PDE4APDE4BPDE4CPDE4DUGCG |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |