Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | ADH1B | P00325 | 1/20 | 0.34 |
| ▸ | ADH1A | P07327 | 1/20 | 0.34 |
| ▸ | ADH7 | P40394 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1072209 | 0.86 | ALDH1A1 (0.48) | CA1ADH1BADH1AADH7CA2 | |
| SCHEMBL5283332 | 0.86 | ALDH1A1 (0.48) | CA1ADH1BADH1AADH7CA2 | |
| Methacrylic Acid SCHEMBL6662141 | 0.85 | PAOX (0.38) | PAOX | |
| SCHEMBL34463483 | 0.77 | CA12 (0.45) | PAOXCA1CA2TSHR | |
| SCHEMBL6018675 | 0.77 | FDPS (0.33) | ALDH1A1 | |
| Sulfuric Acid SCHEMBL15789311 | 0.77 | PAOX (0.52) | PAOXCA1ADH1BADH1AADH7 | |
| Sulfuric Acid SCHEMBL15789313 | 0.77 | PAOX (0.52) | PAOXCA1ADH1BADH1AADH7 | |
| Trifluoromethanesulfonic Acid SCHEMBL20377485 | 0.76 | EPHX1 (0.45) | PAOXCA1ADH1BADH1AADH7 | |
| SCHEMBL28191297 | 0.74 | PAOX (0.50) | PAOXCA1ADH1BADH1AADH7 | |
| SCHEMBL10697148 | 0.74 | ALDH1A1 (0.32) | ALDH1A1 |
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-6177485-B1 | MIXTURE CONTAINING COLORANT, VEHICLE AND POLYMER | HEWLETT-PACKARD COMPANY | 2001-01-23 | — | — | US | disclosed |