Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 3/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 6/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11010240 | 0.93 | AMY1A (0.34) | PDE5AAMY1AENPP1NPC1ALDH1A1 | |
| SCHEMBL11009297 | 0.84 | PDE5A (0.35) | PDE5APDE3BPDE3AAMY1AENPP1 | |
| SCHEMBL11003382 | 0.84 | EGFR (0.31) | — | |
| SCHEMBL11010093 | 0.84 | PDE5A (0.35) | PDE5APDE3BPDE3AAMY1AENPP1 | |
| SCHEMBL11009401 | 0.84 | ENPP1 (0.43) | PDE5APDE3BPDE3AAMY1AENPP1 | |
| SCHEMBL11012150 | 0.83 | HPGD (0.42) | PDE5APDE3BPDE3AENPP1ALDH1A1 | |
| SCHEMBL9634366 | 0.82 | PDE5A (0.47) | PDE5APDE3BPDE3AAMY1AENPP1 | |
| SCHEMBL11012358 | 0.81 | SMN1; SMN2 (0.41) | PDE5APDE3BPDE3ANPC1ALDH1A1 | |
| SCHEMBL11009498 | 0.80 | PDE10A (0.38) | PDE5APDE3BPDE3ANPC1ALDH1A1 | |
| SCHEMBL10740548 | 0.80 | PDE2A (0.42) | PDE5APDE3BPDE3AENPP1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0142075-A2 | Purine derivatives, their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1985-05-22 | — | — | EP | disclosed |