Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.44 |
| ▸ | PDE5A | O76074 | 6/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | GCGR | P47871 | 2/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.37 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.37 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7281824 | 0.99 | PDE5A (0.45) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL10417546 | 0.95 | PDE5A (0.45) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL7272337 | 0.92 | PDE5A (0.45) | PDE2APDE5APDE3BPDE3AAMY1A | |
| SCHEMBL7272110 | 0.90 | PDE2A (0.46) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL7279538 | 0.89 | PDE5A (0.51) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL7282319 | 0.89 | PDE5A (0.54) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| Hydrochloric Acid SCHEMBL10849048 | 0.88 | PDE5A (0.51) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL10417484 | 0.87 | PDE5A (0.45) | PDE2APDE5APDE3BPDE3AAMY1A | |
| SCHEMBL7281308 | 0.87 | PDE2A (0.45) | PDE2APDE5APDE3BPDE3ACYP11B1 | |
| SCHEMBL7271240 | 0.86 | PDE2A (0.48) | PDE2APDE5APDE3BPDE3ACYP11B1 |
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 |