Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | HPGD | P15428 | 3/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | GALR3 | O60755 | 1/20 | 0.69 |
| ▸ | GAA | P10253 | 1/20 | 0.69 |
| ▸ | PDE3A | Q14432 | 8/20 | 0.66 |
| ▸ | PDE3B | Q13370 | 7/20 | 0.66 |
| ▸ | PDE4A | P27815 | 3/20 | 0.66 |
| ▸ | BLM | P54132 | 2/20 | 0.66 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.66 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.66 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.66 |
| ▸ | PDE5A | O76074 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | PDE2A | O00408 | 1/20 | 0.56 |
| ▸ | PDE1A | P54750 | 1/20 | 0.56 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11006744 | 0.85 | HPGD (0.64) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL8210361 | 0.84 | KDM4E (0.75) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL5470727 | 0.82 | HPGD (0.73) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL9587750 | 0.82 | KDM4E (0.73) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL10891425 | 0.82 | KDM4E (0.73) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL7407595 | 0.82 | KDM4E (0.73) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL11002221 | 0.82 | PDE3A (0.68) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL5460125 | 0.82 | KDM4E (1.00) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL11020496 | 0.81 | MEN1 (0.77) | KDM4EHPGDALDH1A1GALR3GAA | |
| SCHEMBL8092522 | 0.80 | GCGR (0.53) | KDM4EHPGDALDH1A1GALR3GAA |
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-4517192-A | 6-Alkyl-5-[4-(alkylsulfinyl or alkylsulfonyl)phenyl]-2(1H)-pyridinones and their use as cardiatonics | STERLING DRUG INC. (US) | 1985-05-14 | — | — | US | disclosed |