Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5335314 | 0.85 | ALDH1A1 (0.40) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL13578757 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL12502653 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL19421857 | 0.79 | ALDH1A1 (0.41) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL3106921 | 0.79 | ALDH1A1 (0.44) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL13478140 | 0.79 | ALDH1A1 (0.39) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL29783582 | 0.78 | ALDH1A1 (0.45) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL14868159 | 0.78 | CHRM2 (0.42) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL17622373 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KMT2AKDM4ETHRBHPGD | |
| SCHEMBL9491373 | 0.78 | ALDH1A1 (0.45) | ALDH1A1KMT2AKDM4ETHRBHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014191358-A1 | NOVEL COMPOUNDS WITH SEMICONDUCTING PROPERTIES | SOLVAY SA (BE) | 2014-12-04 | — | — | WO | disclosed |
| WO-2014191358-A1 | NOVEL COMPOUNDS WITH SEMICONDUCTING PROPERTIES | SOLVAY SA (BE) | 2014-12-04 | — | — | WO | disclosed |
| EP-2808327-A1 | Novel compounds with semiconducting properties | Solvay SA (BE) | 2014-12-03 | — | — | EP | disclosed |
| EP-2808327-A1 | Novel compounds with semiconducting properties | Solvay SA (BE) | 2014-12-03 | — | — | EP | disclosed |