Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1765677 | 0.87 | MGLL (0.50) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL1765727 | 0.86 | MGLL (0.52) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL14640215 | 0.86 | MGLL (0.49) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL1765738 | 0.86 | MGLL (0.52) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL10610256 | 0.86 | MGLL (0.49) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL14551497 | 0.84 | SLC2A1 (0.52) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL12326257 | 0.84 | SLC2A1 (0.52) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL19922892 | 0.84 | MGLL (0.48) | MGLLNPC1CASP1RAB9ATSHR | |
| Hexane SCHEMBL28004600 | 0.84 | MGLL (0.63) | MGLLNPC1CASP1RAB9ATSHR | |
| SCHEMBL8992854 | 0.84 | TSHR (0.56) | NPC1RAB9ATSHRCYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106415910-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2019-05-03 | — | — | CN | disclosed |