Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 6/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.55 |
| ▸ | ADORA2B | P29275 | 6/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.49 |
| ▸ | TNF | P01375 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7463585 | 0.96 | PDE4A (0.57) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7455860 | 0.95 | PDE4A (0.63) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7457088 | 0.94 | PDE4A (0.64) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7454829 | 0.94 | ADORA2A (0.57) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7455511 | 0.92 | ADORA2A (0.58) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7457242 | 0.91 | PDE4A (0.53) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7455573 | 0.91 | ADORA2B (0.56) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7465273 | 0.90 | PDE4A (0.62) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7460905 | 0.90 | ADORA2B (0.51) | PDE4ALMNAESR1CYP1A2MAPT | |
| SCHEMBL7465081 | 0.89 | ADORA2B (0.55) | PDE4ALMNAESR1CYP1A2MAPT |
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-0771813-B1 | Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines | HOECHST AG (DE) | 2002-01-16 | — | — | EP | disclosed |
| EP-0771813-A1 | Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-07 | — | — | EP | disclosed |