Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 7/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.36 |
| ▸ | CFTR | P13569 | 2/20 | 0.34 |
| ▸ | MGMT | P16455 | 2/20 | 0.34 |
| ▸ | PNP | P00491 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.33 |
| ▸ | PDE1A | P54750 | 2/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.33 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.33 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.33 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL8343186 | 0.83 | HPRT1 (0.31) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5048181 | 0.81 | PNP (0.45) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL8343189 | 0.80 | PDE4A (0.35) | PDE4APDE4BPDE4CPDE4DCYP1A2 | |
| SCHEMBL6268093 | 0.79 | ADORA2A (0.42) | PDE4APDE4BPDE4CPDE4DCYP1A2 | |
| SCHEMBL6265343 | 0.77 | PDE4A (0.55) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL6271396 | 0.75 | CDK1 (0.50) | PDE4APDE4BPDE4CPDE4DCYP1A2 | |
| SCHEMBL7758704 | 0.75 | PDE4A (0.39) | PDE4APDE4BPDE4CPDE4DCYP1A2 | |
| SCHEMBL6265538 | 0.74 | MGMT (0.47) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL5504400 | 0.73 | ADORA2A (0.59) | PDE4APDE4BPDE4CPDE4DCYP1A2 | |
| SCHEMBL6267430 | 0.72 | PNP (0.45) | PDE4APDE4BPDE4CPDE4DCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996020212-A2 | PEPTIDE NUCLEIC ACID INCORPORATING A CHIRAL BACKBONE | BUCHARDT, DORTE (DK) | 1996-07-04 | — | — | WO | disclosed |