Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7741486 | 0.79 | CES2 (0.35) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL17322712 | 0.76 | CES2 (0.36) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL172020 | 0.76 | CES2 (0.32) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL7742833 | 0.74 | CES2 (0.35) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL2142264 | 0.73 | CES2 (0.38) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL8789579 | 0.73 | CES2 (0.38) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL8788775 | 0.73 | CES2 (0.38) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL7742834 | 0.73 | MGLL (0.34) | ALDH1A1NPC1RAB9ACES2CES1 | |
| SCHEMBL7739914 | 0.73 | EPHX1 (0.41) | ALDH1A1NPC1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL3075371 | 0.72 | CES2 (0.41) | ALDH1A1NPC1RAB9ACES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6413677-B1 | THIOCARBONATE ELECTROLYTE | UBE INDUSTRIES, LTD. (JP) | 2002-07-02 | — | — | US | disclosed |