Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.84 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.84 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.84 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.84 |
| ▸ | PDE5A | O76074 | 3/20 | 0.72 |
| ▸ | PDE2A | O00408 | 1/20 | 0.72 |
| ▸ | PDE1A | P54750 | 1/20 | 0.72 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.72 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.72 |
| ▸ | HRH4 | Q9H3N8 | 13/20 | 0.54 |
| ▸ | HTR3A | P46098 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL149748 | 0.91 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| Hydrochloric Acid SCHEMBL7502602 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| Hydrochloric Acid SCHEMBL29801523 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL5917668 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| Potassium SCHEMBL7504150 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL5917665 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL7504141 | 0.91 | PDE4A (0.98) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL7502434 | 0.88 | PDE4A (0.92) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL8180935 | 0.86 | PDE4A (0.63) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL7500079 | 0.85 | PDE4A (0.87) | PDE4APDE4BPDE4CPDE4DPDE5A |
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 |
|---|---|---|---|---|---|---|---|
| US-6294550-B1 | ADMINISTERING A VASOACTIVE AGENT FROM ERGOTAMINE DRUG | ASIVI, LLC | 2001-09-25 | — | — | US | disclosed |