Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CYBB | P04839 | 1/20 | 0.31 |
| ▸ | NOX3 | Q9HBY0 | 1/20 | 0.31 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.31 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL17757859 | 0.90 | P2RX7 (0.36) | SMN1; SMN2P2RX7KMT2AMEN1FPR3 | |
| SCHEMBL16410747 | 0.85 | PDE7A (0.38) | P2RX7KMT2AMEN1PDE7BTP53 | |
| SCHEMBL16410824 | 0.85 | PDE7A (0.38) | P2RX7KMT2AMEN1PDE7BTP53 | |
| SCHEMBL17757286 | 0.82 | ACAT2 (0.39) | P2RX7FPR2TP53CYBBNOX3 | |
| SCHEMBL16410790 | 0.81 | LMNA (0.36) | KMT2AMEN1TP53SLC6A2SLC6A4 | |
| SCHEMBL17757544 | 0.81 | P2RX7 (0.35) | P2RX7FPR3FPR2POLBTP53 | |
| SCHEMBL17757379 | 0.81 | P2RX7 (0.35) | P2RX7FPR3FPR2TP53CYBB | |
| SCHEMBL16410615 | 0.77 | KMT2A (0.36) | SMN1; SMN2KMT2A | |
| SCHEMBL16410733 | 0.77 | POLB (0.36) | KMT2APOLB | |
| SCHEMBL16410606 | 0.77 | ACAT2 (0.40) | KMT2ATP53 |
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 |