Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.45 |
| ▸ | CA2 | P00918 | 6/20 | 0.45 |
| ▸ | CA12 | O43570 | 5/20 | 0.45 |
| ▸ | CA9 | Q16790 | 5/20 | 0.45 |
| ▸ | RHOC | P08134 | 1/20 | 0.44 |
| ▸ | RHOA | P61586 | 1/20 | 0.44 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DRD4 | P21917 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL13699235 | 1.00 | CA1 (0.45) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699215 | 0.98 | CA1 (0.47) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699283 | 0.93 | TP53BP1 (0.45) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699282 | 0.86 | CA2 (0.48) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699325 | 0.86 | CA2 (0.48) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699284 | 0.83 | CA2 (0.50) | CA1CA2CA12CA9RHOC | |
| SCHEMBL13699191 | 0.81 | NAMPT (0.46) | CA2RHOCRHOATP53BP1NAMPT | |
| SCHEMBL31019755 | 0.80 | CA1 (0.40) | CA1CA2CA12CA9RAB9A | |
| SCHEMBL30047877 | 0.80 | CA1 (0.40) | CA1CA2CA12CA9RAB9A | |
| SCHEMBL13699232 | 0.78 | CA2 (0.52) | CA1CA2CA9RHOCRHOA |
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-2009113704-A2 | FLUORINE-CONTAINING COMPOUND AND METHOD FOR DETECTING BIOMOLECULE USING THE SAME | KYOTO UNIVERSITY (JP) | 2009-09-17 | — | — | WO | disclosed |