Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.35 |
| ▸ | AKT2 | P31751 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16410633 | 0.87 | ACAT2 (0.37) | ACAT2AKT2MAOBHTR6KMT2A | |
| SCHEMBL16410730 | 0.87 | ACAT2 (0.39) | ACAT2MAOBKMT2AP2RX7KDM4E | |
| SCHEMBL17757890 | 0.78 | PDE7A (0.38) | ACAT2MAOBHTR6KMT2AP2RX7 | |
| SCHEMBL16410840 | 0.77 | ACAT2 (0.42) | ACAT2KMT2AMETAP2KDM4ECHRM2 | |
| SCHEMBL17757572 | 0.77 | ACAT2 (0.40) | ACAT2MAOBHTR6KMT2AP2RX7 | |
| SCHEMBL17757791 | 0.77 | ACAT2 (0.49) | ACAT2MAOBHTR6KMT2AP2RX7 | |
| SCHEMBL16410643 | 0.77 | ACAT2 (0.35) | ACAT2AKT2MAOBHTR6KMT2A | |
| SCHEMBL16410598 | 0.76 | ACAT2 (0.36) | ACAT2KMT2AMETAP2KDM4ECHRM2 | |
| SCHEMBL16410687 | 0.76 | ACAT2 (0.34) | ACAT2MAOB | |
| SCHEMBL16410691 | 0.76 | CXCR4 (0.30) | CXCR4 |
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 |