Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22018367 | 0.92 | MEN1 (0.40) | RAB9AL3MBTL1ADRB2MAPTKDM4E | |
| SCHEMBL22019249 | 0.86 | KDM4E (0.33) | RAB9AMAPTKDM4EALDH1A1GAA | |
| SCHEMBL22018368 | 0.85 | KDM4E (0.33) | RAB9AMAPTKDM4EALDH1A1GAA | |
| SCHEMBL22018387 | 0.84 | RAB9A (0.46) | RAB9AL3MBTL1ADRB2MAPTKDM4E | |
| SCHEMBL22018372 | 0.83 | MAPT (0.33) | RAB9AL3MBTL1ADRB2MAPTKDM4E | |
| SCHEMBL20783954 | 0.78 | HSD17B10 (0.41) | RAB9AL3MBTL1MAPTKDM4EALDH1A1 | |
| SCHEMBL22018384 | 0.75 | MEN1 (0.44) | RAB9AL3MBTL1ADRB2MAPTKDM4E | |
| SCHEMBL22585357 | 0.72 | ALDH1A1 (0.37) | RAB9AL3MBTL1MAPTKDM4EALDH1A1 | |
| SCHEMBL31152129 | 0.72 | ALDH1A1 (0.37) | RAB9AL3MBTL1MAPTKDM4EALDH1A1 | |
| SCHEMBL24294132 | 0.72 | ALDH1A1 (0.37) | RAB9AL3MBTL1MAPTKDM4EALDH1A1 |
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-2020099793-A1 | NOVEL BENZOTHIOXANTHENE P-CONJUGATED MOLECULES FOR ENERGY STORAGE | UNIVERSITE D'ANGERS (FR) | 2020-05-22 | — | — | WO | disclosed |