Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PPM1D | O15297 | 3/20 | 0.31 |
| ▸ | HTR2B | P41595 | 3/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | MPO | P05164 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410746 | 0.82 | KMT2A (0.34) | KMT2ANPC1RAB9ALMNAHTT | |
| SCHEMBL19934614 | 0.82 | HIF1A (0.44) | TSHRNPC1RAB9ALMNAHTT | |
| SCHEMBL16410739 | 0.81 | KMT2A (0.39) | TSHRKMT2ANPC1RAB9ALMNA | |
| SCHEMBL16410606 | 0.81 | ACAT2 (0.40) | KMT2AHTT | |
| SCHEMBL16410622 | 0.80 | KMT2A (0.37) | KMT2ANPC1RAB9AGAA | |
| SCHEMBL17757867 | 0.79 | PPM1D (0.44) | KMT2ALMNAPPM1DHIF1A | |
| SCHEMBL16410618 | 0.78 | KDM4E (0.31) | KMT2ANPC1RAB9AGAA | |
| SCHEMBL16410740 | 0.78 | MEN1 (0.35) | KMT2AMEN1 | |
| SCHEMBL16410790 | 0.77 | LMNA (0.36) | KMT2ALMNAHTTPARP1MEN1 | |
| SCHEMBL19523254 | 0.77 | TDO2 (0.39) | NPC1RAB9APARP1L3MBTL1 |
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 |