Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | ADH1B | P00325 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4237376 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL28202622 | 0.90 | PAOX (0.37) | PAOXTSHRALDH1A1ADH1BADH1A | |
| SCHEMBL15973371 | 0.88 | ALDH1A1 (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL745703 | 0.88 | ALDH1A1 (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL7702557 | 0.88 | ALDH1A1 (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL118049 | 0.88 | ALDH1A1 (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL15109890 | 0.88 | ALDH1A1 (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL4230818 | 0.88 | TSHR (0.50) | PAOXTSHRALDH1A1CYP2C19CYP1A2 | |
| Hydrochloric Acid SCHEMBL6546522 | 0.86 | ALDH1A1 (0.56) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| Hydrochloric Acid SCHEMBL283010 | 0.86 | ALDH1A1 (0.56) | TSHRALDH1A1S1PR2S1PR4S1PR1 |
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-6160022-A | Chemical resection of pancreas | UNIVERSITY OF FLORIDA (US) | 2000-12-12 | — | — | US | disclosed |