Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGER | Q15109 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | VDR | P11473 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL743574 | 0.88 | GAA (0.44) | AGERSTAT3CA1CA12CA9 | |
| SCHEMBL19436459 | 0.80 | GAA (0.43) | STAT3CA1CA12CA9GAA | |
| SCHEMBL1980138 | 0.80 | GAA (0.43) | STAT3CA1CA12CA9GAA | |
| SCHEMBL68796 | 0.80 | GAA (0.43) | STAT3CA1CA12CA9GAA | |
| SCHEMBL1742195 | 0.80 | GAA (0.46) | STAT3CA1CA12CA9GAA | |
| SCHEMBL28300633 | 0.79 | GAA (0.42) | STAT3CA1CA12CA9GAA | |
| SCHEMBL28998782 | 0.79 | ALDH1A1 (0.43) | STAT3CA1CA12CA9GAA | |
| SCHEMBL979617 | 0.79 | ALDH1A1 (0.43) | STAT3CA1CA12CA9GAA | |
| SCHEMBL2057211 | 0.79 | ALDH1A1 (0.46) | STAT3CA1CA12CA9GAA | |
| SCHEMBL2533175 | 0.78 | GAA (0.41) | STAT3CA1CA12CA9GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1746079-A2 | Fluorinated biphenyl compounds for use in liquid crystal compositions | Merck Patent GmbH (DE) | 2007-01-24 | — | — | EP | disclosed |