Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | APLNR | P35414 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14253761 | 0.79 | SMN1; SMN2 (0.33) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL10944528 | 0.74 | KDM4E (0.37) | ALDH1A1TDP1 | |
| SCHEMBL6268717 | 0.74 | — | — | |
| SCHEMBL2125474 | 0.72 | — | — | |
| SCHEMBL475392 | 0.65 | — | — | |
| SCHEMBL13103972 | 0.64 | CNR1 (0.36) | ALDH1A1TDP1 | |
| Sulfuric Acid SCHEMBL22983822 | 0.63 | CA5A (0.33) | — | |
| SCHEMBL20173258 | 0.63 | — | — | |
| SCHEMBL15463081 | 0.63 | — | — | |
| SCHEMBL6510022 | 0.63 | — | — |
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-1519756-B1 | USE OF METAL COMPLEXES CONTAINING PERFLUOROALKYL AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING FOR REPRESENTING INTRAVASCULAR THROMBI | BAYER SCHERING PHARMA AG (DE) | 2007-05-02 | — | — | EP | disclosed |