Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15592597 | 0.76 | ALDH1A1 (0.40) | TSHRALDH1A1 | |
| SCHEMBL6947156 | 0.76 | CASP1 (0.53) | TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL1750320 | 0.74 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL5871698 | 0.72 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL31394302 | 0.71 | LTA4H (0.42) | ALDH1A1 | |
| SCHEMBL9506098 | 0.71 | L3MBTL1 (0.53) | TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL1749447 | 0.70 | LTA4H (0.41) | ALDH1A1 | |
| SCHEMBL28516086 | 0.70 | L3MBTL1 (0.55) | ALDH1A1 | |
| SCHEMBL1749856 | 0.70 | LTA4H (0.41) | ALDH1A1 | |
| SCHEMBL14156321 | 0.69 | NPC1 (0.54) | TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012151567-A1 | PYRIMIDINONE COMPOUNDS AND METHODS FOR PREVENTING AND TREATING INFLUENZA | ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) | 2012-11-08 | — | — | WO | disclosed |