Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.37 |
| ▸ | CDK2 | P24941 | 4/20 | 0.37 |
| ▸ | CDK1 | P06493 | 3/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3005658 | 0.86 | CCNE1 (0.49) | PDE4APDE4BPDE4CPDE4DCCNE1 | |
| SCHEMBL2999175 | 0.85 | CCNE1 (0.37) | CCNE1CDK2CDK1CCNB1 | |
| SCHEMBL2995693 | 0.85 | HSP90AB1 (0.42) | CCNE1CDK2CDK1CCNB1HSP90AA1 | |
| SCHEMBL3000253 | 0.82 | PDE4A (0.38) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL3260746 | 0.82 | CCNE1 (0.41) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL2988381 | 0.82 | CDK2 (0.36) | CCNE1CDK2CDK1CCNB1MAPK1 | |
| SCHEMBL3260742 | 0.81 | CCNE1 (0.40) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL2912568 | 0.80 | PDE4A (0.35) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL2996736 | 0.79 | HDAC1 (0.45) | — | |
| SCHEMBL2996929 | 0.78 | CYP1A2 (0.40) | PDE4APDE4BPDE4CPDE4DCCNE1 |
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-1358198-B1 | NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME | LG LIFE SCIENCES LTD (KR) | 2010-08-25 | — | — | EP | claimed |