Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 10/20 | 0.46 |
| ▸ | GGPS1 | O95749 | 7/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945806 | 0.97 | FDPS (0.48) | FDPSGGPS1CES2SMPD1TSHR | |
| SCHEMBL2357872 | 0.97 | FDPS (0.48) | FDPSGGPS1CES2SMPD1TSHR | |
| SCHEMBL2349836 | 0.91 | ESR1 (0.39) | FDPSGGPS1CES2TSHR | |
| SCHEMBL3458842 | 0.81 | FDPS (0.41) | FDPSGGPS1 | |
| SCHEMBL17311057 | 0.80 | FDPS (0.44) | FDPSGGPS1CES2SMPD1TSHR | |
| SCHEMBL28647556 | 0.78 | FDPS (0.43) | FDPSGGPS1CES2SMPD1 | |
| SCHEMBL31619586 | 0.78 | FDPS (0.46) | FDPSGGPS1CES2SMPD1TSHR | |
| SCHEMBL32684877 | 0.78 | FDPS (0.46) | FDPSGGPS1CES2SMPD1TSHR | |
| SCHEMBL8094732 | 0.78 | CES1 (0.52) | FDPSGGPS1CES2 | |
| SCHEMBL28233886 | 0.78 | FDPS (0.46) | FDPSGGPS1CES2SMPD1TSHR |
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-20230068565-A1 | LOW-HARM CIGARETTE SUBJECTED TO SMOKE ENHANCEMENT | CHINA TOBACCO HUNAN INDUSTRIAL CO., LTD. (CN) | 2023-03-02 | — | — | US | disclosed |