Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 7/20 | 0.42 |
| ▸ | CA2 | P00918 | 7/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 6/20 | 0.38 |
| ▸ | CA9 | Q16790 | 6/20 | 0.38 |
| ▸ | CA7 | P43166 | 3/20 | 0.38 |
| ▸ | CA3 | P07451 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 2/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL8967252 | 0.77 | ALOX12 (0.52) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL27280596 | 0.77 | ALOX12 (0.58) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL664006 | 0.76 | ALOX12 (0.65) | CA1CA2ALOX12LMNATSHR | |
| SCHEMBL8767942 | 0.76 | — | — | |
| Toluene SCHEMBL4651397 | 0.75 | ALOX12 (0.50) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL29254309 | 0.75 | ALOX12 (0.50) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL10575248 | 0.75 | ALOX12 (0.50) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL21814538 | 0.73 | TSHR (0.52) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL5761954 | 0.73 | ALOX12 (0.52) | CA1CA2ALOX12LMNATSHR | |
| Toluene SCHEMBL28179878 | 0.73 | ALOX12 (0.52) | CA1CA2ALOX12LMNATSHR |
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-0351603-B1 | Transvinylation reaction | UNION CARBIDE CORP (US) | 1994-12-07 | — | — | EP | claimed |