Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | ALPI | P09923 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | WDR5 | P61964 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL4721150 | 0.92 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4720223 | 0.90 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4723271 | 0.89 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4719190 | 0.89 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DEGFR | |
| SCHEMBL14101992 | 0.88 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DEGFR | |
| SCHEMBL4720114 | 0.88 | PDE4A (0.47) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4722274 | 0.87 | PDE4A (0.48) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4720922 | 0.87 | F10 (0.39) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4722933 | 0.87 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DGRM7 | |
| SCHEMBL4721033 | 0.87 | F10 (0.39) | PDE4APDE4BPDE4CPDE4DEGFR |
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 2 patents. 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 |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |