Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 8/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.44 |
| ▸ | PNP | P00491 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | NT5E | P21589 | 8/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22700332 | 0.81 | PDE2A (0.57) | PDE2AADORA2APDE4DPDE3APNP | |
| SCHEMBL19974427 | 0.78 | ADORA2A (0.68) | PDE2AADORA2APDE4DPDE3APNP | |
| SCHEMBL19979098 | 0.73 | LMNA (0.37) | PDE2ALMNATP53NT5E | |
| SCHEMBL19979260 | 0.72 | PDE2A (0.49) | PDE2AADORA2APDE4DPDE3APNP | |
| SCHEMBL19974448 | 0.69 | ADORA2A (0.55) | PDE2AADORA2APDE4DPDE3APNP | |
| SCHEMBL22700164 | 0.68 | PDE2A (0.52) | PDE2AADORA3NT5E | |
| SCHEMBL19978932 | 0.67 | PDE2A (0.49) | PDE2AADORA2AADORA3NT5E | |
| SCHEMBL21783562 | 0.67 | PDE2A (0.62) | PDE2AADORA2APDE4DPDE3AADORA2B | |
| SCHEMBL9404549 | 0.67 | ADORA2A (0.44) | PDE2AADORA2APDE4DPDE3AADORA2B | |
| SCHEMBL10709057 | 0.67 | ADORA2A (0.48) | PDE2AADORA2APDE4DPDE3APNP |
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-2018049534-A1 | NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT | LCB PHARMA INC. (CA) | 2018-03-22 | — | — | WO | disclosed |