Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL6540266 | 0.83 | LTA4H (0.41) | CASRTP53TSHR | |
| SCHEMBL27466473 | 0.81 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL27823090 | 0.79 | LTA4H (0.41) | PLA2G4BCASRTP53TSHR | |
| SCHEMBL29690459 | 0.78 | ALDH1A1 (0.38) | ALDH1A1PLA2G4BCASRTSHR | |
| SCHEMBL28035354 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR | |
| SCHEMBL28035370 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR | |
| SCHEMBL28035407 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR | |
| SCHEMBL6541581 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR | |
| SCHEMBL6678195 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR | |
| SCHEMBL6541323 | 0.77 | NPC1 (0.42) | ALDH1A1PLA2G4BCASRTP53TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0670184-B1 | Method of demineralizing water or an aqueous solution | MITSUBISHI CHEM CORP (JP) | 2001-09-05 | — | — | EP | disclosed |
| US-5518627-A | DEMINERALIZATION, BASIC ANION EXCHANGE RESIN | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-05-21 | — | — | US | disclosed |
| EP-0670184-A2 | Method of demineralizing water or an aqueous solution | Mitsubishi Chemical Corporation (JP) | 1995-09-06 | — | — | EP | disclosed |