Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL30903370 | 1.00 | ENPP2 (0.42) | ENPP2POLBESR2GPR119ALDH1A1 | |
| SCHEMBL30903376 | 1.00 | ENPP2 (0.42) | ENPP2POLBESR2GPR119ALDH1A1 | |
| SCHEMBL29268343 | 0.88 | MAPT (0.43) | ENPP2GPR119ALDH1A1LMNAMAPT | |
| SCHEMBL30903386 | 0.88 | MAPT (0.43) | ENPP2GPR119ALDH1A1LMNAMAPT | |
| SCHEMBL26629245 | 0.81 | NR1H2 (0.46) | ENPP2POLBESR2GPR119ALDH1A1 | |
| SCHEMBL31342592 | 0.79 | SUV39H2 (0.44) | ESR2GPR119ALDH1A1LMNAMAPT | |
| SCHEMBL27333597 | 0.79 | NR1H2 (0.41) | ENPP2ESR2GPR119ALDH1A1LMNA | |
| SCHEMBL14899254 | 0.79 | MEN1 (0.54) | ENPP2ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL14894490 | 0.78 | LMNA (0.43) | ENPP2ESR2GPR119ALDH1A1LMNA | |
| SCHEMBL5891913 | 0.78 | P2RX7 (0.58) | ENPP2POLBESR2GPR119MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-118076585-A | Gram negative bacteria efflux pump inhibitors | 国家医疗保健研究所 | 2024-05-24 | — | — | CN | disclosed |
| WO-2023002011-A1 | GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-01-26 | — | — | WO | disclosed |