Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.49 |
| ▸ | TMIGD3 | P0DMS9 | 3/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | FLT4 | P35916 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18066312 | 0.90 | NT5E (0.51) | CYP1A2HTTADORA2AADORA1TMIGD3 | |
| SCHEMBL3457849 | 0.86 | EGFR (0.54) | HTTADORA2AADORA1EGFRPDE4A | |
| SCHEMBL20008181 | 0.86 | ADORA2A (0.58) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL20833463 | 0.85 | RAB9A (0.48) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL26230942 | 0.85 | P2RY1 (0.47) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL31087988 | 0.84 | NPC1 (0.49) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL7263226 | 0.82 | ADORA2A (0.52) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL7262512 | 0.82 | ADORA2A (0.52) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL7262510 | 0.82 | ADORA2A (0.52) | HTTADORA2AADORA1TMIGD3EGFR | |
| SCHEMBL2758372 | 0.82 | CDK1 (0.56) | CYP1A2ADORA2AADORA1RAB9ACDK1 |
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-0206459-B1 | 9-(PHOSPHONYLMETHOXYALKYL) ADENINES, METHOD FOR THEIR PREPARATION AND THEIR USE | Ceskoslovenska akademie ved (CS) | 1992-07-15 | — | — | EP | disclosed |
| EP-0206459-A2 | 9-(Phosphonylmethoxyalkyl) adenines, method for their preparation and their use | Ceskoslovenska akademie ved (CS) | 1986-12-30 | — | — | EP | disclosed |