Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3A | Q14432 | 5/20 | 0.63 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GALR3 | O60755 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.44 |
| ▸ | PDE4A | P27815 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11230321 | 0.86 | PDE3B (0.54) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL8146253 | 0.85 | PDE3A (0.45) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL10987296 | 0.84 | PDE3A (0.62) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL7272616 | 0.83 | KDM4E (0.63) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL10989435 | 0.82 | PDE3A (0.63) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL11238807 | 0.81 | PDE3A (0.58) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL10998629 | 0.77 | PDE3A (1.00) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL7349019 | 0.76 | PDE3A (0.62) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL11223772 | 0.76 | PDE3A (0.73) | PDE3APDE3BKDM4EHPGDALDH1A1 | |
| SCHEMBL10707484 | 0.76 | PDE3B (0.73) | PDE3APDE3BKDM4EHPGDALDH1A1 |
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-4312875-A | 5-(Pyridinyl)-6-(lower-alkyl)-2(1H)-pyridinones, 1,2-dihydro-2-oxo-5-(pyridinyl)-6-(lower-alkyl)nicotinic acids and lower-alkyl esters thereof, and cardiotonic use thereof | STERLING DRUG INC. (US) | 1982-01-26 | — | — | US | disclosed |