Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | GCG | P01275 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL13376130 | 0.83 | TSHR (0.39) | ESR2 | |
| SCHEMBL39146 | 0.81 | NPC1 (0.45) | — | |
| SCHEMBL29350743 | 0.81 | NPC1 (0.45) | — | |
| SCHEMBL27600005 | 0.80 | NPC1 (0.44) | — | |
| SCHEMBL586578 | 0.80 | NPC1 (0.44) | — | |
| SCHEMBL11457333 | 0.80 | NPC1 (0.44) | — | |
| SCHEMBL8855668 | 0.80 | ESR2 (0.37) | ESR2GCG | |
| Hydrochloric Acid SCHEMBL5980727 | 0.79 | NPC1 (0.43) | — | |
| Phenol SCHEMBL28007822 | 0.77 | NPC1 (0.41) | — | |
| SCHEMBL4409726 | 0.77 | IDH1 (0.38) | ESR2SLC6A2 |
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-20160280863-A1 | MELT-STABILIZED ULTRA HIGH MOLECULAR WEIGHT ANTIOXIDANT | ZIMMER, INC. | 2016-09-29 | — | — | US | disclosed |