Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 8/20 | 0.36 |
| ▸ | GLB1 | P16278 | 1/20 | 0.36 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.35 |
| ▸ | GUSB | P08236 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8022112 | 1.00 | GBA1 (0.36) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8031468 | 1.00 | GBA1 (0.36) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8022095 | 1.00 | GBA1 (0.36) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8035667 | 1.00 | GBA1 (0.36) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8022160 | 0.93 | EPHX2 (0.35) | GLB1GBA2 | |
| SCHEMBL9955184 | 0.87 | PSMD14 (0.34) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL2007679 | 0.87 | PSMD14 (0.34) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8034064 | 0.87 | PSMD14 (0.34) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8022094 | 0.87 | PSMD14 (0.40) | GBA1GLB1GBA2SPHK1GUSB | |
| SCHEMBL8035780 | 0.87 | PSMD14 (0.40) | GBA1GLB1GBA2SPHK1GUSB |
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-6042750-A | TETRAALKYLAMMONIUM HALIDE, ALKYLENEDIAMINE, ALIPHATIC HYDROCARBON HYDROXY IMIDAZOLINE, POLYOXYETHYLENE GLYCOL ESTERS AND AMINES, TRIALKANOLAMINE, AND AMINE OXYALKYLATE; PIPES | Docter, Joan (US) | 2000-03-28 | — | — | US | disclosed |