Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2558542 | 0.82 | PDK2 (0.47) | PDK2ALKHPGDPLA2G7KDM4E | |
| SCHEMBL18758134 | 0.80 | PDK2 (0.44) | PDK2ALKHPGDPLA2G7ALDH1A1 | |
| SCHEMBL29283179 | 0.80 | KDM4E (0.57) | PDK2KDM4EALDH1A1MAPTTDP1 | |
| SCHEMBL29283173 | 0.76 | LTA4H (0.50) | PDK2ALKPLA2G7KDM4EALDH1A1 | |
| SCHEMBL18914878 | 0.75 | PDK2 (0.44) | PDK2ALKHPGDPLA2G7SCN9A | |
| SCHEMBL14947221 | 0.74 | BRD4 (0.35) | PDK2ALKALDH1A1SCN9ABRD4 | |
| SCHEMBL15502468 | 0.70 | PDK2 (0.57) | PDK2HPGDKDM4ETDP1SCN9A | |
| SCHEMBL29954771 | 0.70 | PDK2 (0.49) | PDK2ALKMAPTTDP1SCN9A | |
| SCHEMBL2553749 | 0.70 | PDK2 (0.49) | PDK2ALKMAPTTDP1SCN9A | |
| SCHEMBL13100474 | 0.70 | NR1I2 (0.46) | HPGDALDH1A1MAPTPTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017064296-A1 | METHOD FOR SYNTHESISING AROMATIC NITRONES | ARKEMA FRANCE (FR) | 2017-04-20 | — | — | WO | disclosed |