Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | VDR | P11473 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13117464 | 0.90 | ALDH1A1 (0.39) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13213444 | 0.83 | ALDH1A1 (0.37) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL2904151 | 0.82 | ALDH1A1 (0.39) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13117466 | 0.81 | ALDH1A1 (0.39) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13117462 | 0.81 | ALDH1A1 (0.39) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13213336 | 0.81 | MAPT (0.43) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13140334 | 0.74 | CNR1 (0.36) | VDRMAPTKDM4ETSHRPDCD1 | |
| SCHEMBL12577729 | 0.74 | KDM4E (0.39) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13117432 | 0.72 | MAPT (0.41) | ALDH1A1VDRMAPTHTTNPSR1 | |
| SCHEMBL13117592 | 0.72 | PDE2A (0.32) | ALDH1A1PDCD1CD274 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2216330-A1 | OXADIAZOLIDINEDIONE COMPOUND | Astellas Pharma Inc. (JP) | 2010-08-11 | — | — | EP | disclosed |