Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 6/20 | 0.38 |
| ▸ | PDE7B | Q9NP56 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | ACAT2 | Q9BWD1 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | NR4A1 | P22736 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16410715 | 0.90 | — | — | |
| SCHEMBL16410850 | 0.88 | — | — | |
| SCHEMBL16410770 | 0.79 | ACAT2 (0.44) | PDE7APDE7BLMNAACAT2KDM4E | |
| SCHEMBL16410712 | 0.77 | ACAT2 (0.38) | PDE7APDE7BACAT2KDM4EMAPT | |
| SCHEMBL16410654 | 0.75 | TSHR (0.37) | PDE7APDE7BACAT2MAPTPDE5A | |
| SCHEMBL16410755 | 0.75 | ACAT2 (0.43) | PDE7AACAT2KDM4EMAPTMEN1 | |
| SCHEMBL16410816 | 0.74 | ACAT2 (0.45) | PDE7ASLC6A4GRIN2BACAT2KMT2A | |
| SCHEMBL17757617 | 0.73 | PDE7A (0.39) | PDE7APDE7BGRIN1GRIN2ASLC6A4 | |
| SCHEMBL16410620 | 0.73 | ACAT2 (0.36) | PDE7AACAT2KDM4EMAPTKMT2A | |
| SCHEMBL16410750 | 0.73 | ACAT2 (0.39) | PDE7ASLC6A4ACAT2KMT2A |
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-2015007730-A1 | SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2015-01-22 | — | — | WO | disclosed |