Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 5/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7272319 | 0.94 | PDE2A (0.42) | PDE5APDE2APDE3BPDE3AAMY1A | |
| Hydrochloric Acid SCHEMBL7281818 | 0.93 | PDE5A (0.43) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL10417483 | 0.92 | PDE5A (0.44) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL7272106 | 0.90 | PDE2A (0.43) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL7272331 | 0.86 | PDE5A (0.45) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL7282319 | 0.85 | PDE5A (0.54) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL10985304 | 0.84 | ALDH1A1 (0.38) | PDE5AACHEPDPK1AURKAKDR | |
| SCHEMBL7271954 | 0.84 | PDE5A (0.44) | PDE5APDE2APDE3BPDE3AAMY1A | |
| SCHEMBL9636108 | 0.82 | PDE2A (0.47) | PDE5APDE2APDE3BPDE3AAMY1A | |
| Hydrochloric Acid SCHEMBL7278437 | 0.82 | PDE5A (0.60) | PDE5APDE2APDE3BPDE3AAMY1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |