Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 20/20 | 0.68 |
| ▸ | PDE1A | P54750 | 4/20 | 0.68 |
| ▸ | PDE1B | Q01064 | 4/20 | 0.68 |
| ▸ | PDE1C | Q14123 | 4/20 | 0.68 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.68 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.68 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.68 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.68 |
| ▸ | PDE2A | O00408 | 1/20 | 0.68 |
| ▸ | ABCC5 | O15440 | 1/20 | 0.68 |
| ▸ | PDE6D | O43924 | 1/20 | 0.68 |
| ▸ | PDE8A | O60658 | 1/20 | 0.68 |
| ▸ | PDE9A | O76083 | 1/20 | 0.68 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | HTR1A | P08908 | 1/20 | 0.68 |
| ▸ | PDE6A | P16499 | 1/20 | 0.68 |
| ▸ | PDE6G | P18545 | 1/20 | 0.68 |
| ▸ | PDE4A | P27815 | 1/20 | 0.68 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| Sildenafil SCHEMBL492566 | 0.94 | PDE5A (0.77) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL2033330 | 0.91 | PDE5A (0.66) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL18912666 | 0.88 | PDE5A (0.51) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL12341666 | 0.88 | PDE5A (0.65) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL19254528 | 0.87 | PDE5A (0.78) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL18912667 | 0.87 | PDE5A (0.65) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL19518061 | 0.86 | PDE5A (0.77) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL30199978 | 0.85 | PDE5A (0.74) | PDE5APDE1APDE1BPDE1CPDE3B | |
| SCHEMBL13633773 | 0.85 | PDE5A (0.63) | PDE5APDE1APDE1BPDE1CPDE3B | |
| Lodenafil SCHEMBL18416781 | 0.85 | PDE5A (0.78) | PDE5APDE1APDE1BPDE1CPDE3B |
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-2017090007-A1 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF UREA CYCLE DISORDERS AND HEPATIC DISEASES | RAO M SURYA (IN) | 2017-06-01 | — | — | WO | disclosed |