Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 2/20 | 0.35 |
| ▸ | FABP3 | P05413 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.30 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.30 |
| ▸ | LIPG | Q9Y5X9 | 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 | |
|---|---|---|---|---|
| SCHEMBL17758050 | 0.90 | BRD9 (0.39) | BRD4BRD9FABP3FABP4CYP3A4 | |
| SCHEMBL16410661 | 0.89 | ACAT2 (0.35) | BRD9FABP3FABP4CYP3A4CYP2C19 | |
| SCHEMBL16410627 | 0.81 | SLC6A2 (0.33) | KMT2A | |
| SCHEMBL17757112 | 0.81 | FABP3 (0.39) | BRD4BRD9FABP3FABP4CYP3A4 | |
| SCHEMBL17757735 | 0.79 | BRD9 (0.38) | BRD4BRD9FABP3FABP4CYP3A4 | |
| SCHEMBL17757086 | 0.78 | FABP3 (0.35) | BRD4BRD9FABP3FABP4CYP3A4 | |
| SCHEMBL17757538 | 0.77 | GAA (0.40) | CYP3A4CYP2C19KMT2A | |
| SCHEMBL16410867 | 0.77 | ALDH1A1 (0.34) | KMT2A | |
| SCHEMBL16410745 | 0.76 | TAAR1 (0.35) | KMT2A | |
| SCHEMBL16410796 | 0.75 | ACAT2 (0.30) | — |
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 |