Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17757117 | 0.90 | ACAT2 (0.37) | ACAT2KDM4ENPC1GAAMAPT | |
| SCHEMBL17757284 | 0.90 | ACAT2 (0.37) | ACAT2NPC1RAB9AHTT | |
| SCHEMBL17757203 | 0.88 | ACAT2 (0.38) | ACAT2KDM4ENPC1GAAMAPT | |
| SCHEMBL17757739 | 0.88 | ACAT2 (0.37) | ACAT2KDM4EMAPT | |
| SCHEMBL17992043 | 0.88 | ACAT2 (0.33) | ACAT2HTT | |
| SCHEMBL17757540 | 0.88 | GAA (0.34) | KDM4ENPC1GAAMAPTMAPK1 | |
| SCHEMBL17757357 | 0.88 | LMNA (0.31) | KDM4ENPC1GAAMAPTMAPK1 | |
| SCHEMBL19523251 | 0.86 | PTPN1 (0.43) | KDM4EGAAMAPTRAB9A | |
| SCHEMBL17757717 | 0.86 | ACAT2 (0.40) | ACAT2KDM4ENPC1GAAMAPT | |
| SCHEMBL17757733 | 0.86 | ACAT2 (0.34) | ACAT2HTT |
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-2016075137-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2016-05-19 | — | — | WO | disclosed |