Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 7/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | GUSB | P08236 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7279838 | 0.91 | CYP1A2 (0.43) | PDE5ACYP2C9CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL7279562 | 0.85 | CYP2C9 (0.49) | PDE5ACYP2C9CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL7280960 | 0.79 | PDE5A (0.45) | PDE5APDE3BPDE3APDE10AGUSB | |
| SCHEMBL7279872 | 0.79 | CBFB (0.46) | PDE5APDE3BPDE3APDE10AGUSB | |
| SCHEMBL7270623 | 0.78 | PDE5A (0.45) | PDE5APDE3BPDE3APDE10AGUSB | |
| SCHEMBL7281156 | 0.78 | PDE5A (0.48) | PDE5ACYP2C9CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL9635782 | 0.78 | PDE5A (0.44) | PDE5APDE3BPDE3APDE10AGUSB | |
| SCHEMBL10964300 | 0.77 | CYP3A4 (0.41) | PDE5ACYP2C9CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL7272286 | 0.77 | PDE2A (0.50) | PDE5APDE3BPDE3A | |
| SCHEMBL9636112 | 0.76 | PDE5A (0.41) | PDE5APDE3BPDE3APDE10AGUSB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4904785-A | INOTROPIC AGENTS FOR CARDIOVASCULAR DISORDERS | ELI LILLY AND COMPANY (US) | 1990-02-27 | — | — | US | disclosed |
| US-4758574-A | 2-phenylimidazio (4,5-c) pyridines | ELI LILLY AND COMPANY (US) | 1988-07-19 | — | — | US | disclosed |
| EP-0093593-A2 | Pyridine compounds | ELI LILLY AND COMPANY (US) | 1983-11-09 | — | — | EP | disclosed |