Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 5/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.31 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.30 |
| ▸ | PI4KA | P42356 | 1/20 | 0.30 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.30 |
| ▸ | PI4K2A | Q9BTU6 | 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 | |
|---|---|---|---|---|
| SCHEMBL6256171 | 0.84 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP2D6HPGDHIF1A | |
| SCHEMBL4543346 | 0.79 | XDH (0.40) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL3128444 | 0.78 | TLR7 (0.47) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL6258351 | 0.76 | PDE4A (0.32) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6252841 | 0.76 | PDE4A (0.38) | ALDH1A1HPGDPDE4APDE4BPDE4C | |
| SCHEMBL6256895 | 0.76 | PDE4A (0.63) | ALDH1A1CYP1A2HIF1APDE4APDE4B | |
| SCHEMBL3136315 | 0.74 | PDE4A (0.59) | ALDH1A1CYP1A2CYP2D6HPGDHIF1A | |
| SCHEMBL6259489 | 0.74 | PDE4A (0.37) | ALDH1A1HPGDPDE4APDE4BPDE4C | |
| SCHEMBL6257278 | 0.74 | YTHDC1 (0.40) | ALDH1A1CYP1A2CYP2D6HPGDPDE4D | |
| SCHEMBL6256303 | 0.73 | ADORA2A (0.40) | ALDH1A1CYP1A2PI4KAPI4K2BPI4K2A |
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-1529049-A2 | DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS | Memory Pharmaceutical Corporation (US) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004014913-A2 | DERIVATIVES OF 2-TRIFLUORMETHYL-6-AMINOPURINE AS PHOSPHODIESTERASE 4 INHIBITORS | MEMORY PHARMACEUTICALS CORPORATION (US) | 2004-02-19 | — | — | WO | disclosed |