Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.51 |
| ▸ | PPARD | Q03181 | 1/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.44 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.44 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8080149 | 0.84 | PPARA (0.61) | PPARAPPARDABCG2KDM4EMEN1 | |
| SCHEMBL8080152 | 0.84 | PPARA (0.61) | PPARAPPARDABCG2KDM4EMEN1 | |
| SCHEMBL27993003 | 0.82 | GRIK1 (0.56) | BCHE | |
| SCHEMBL10740482 | 0.81 | PPARA (0.57) | PPARAPPARDKMT2APPARGALB | |
| SCHEMBL10740476 | 0.81 | PPARA (0.57) | PPARAPPARDKMT2APPARGALB | |
| SCHEMBL7999920 | 0.81 | ABCG2 (0.50) | PPARAPPARDABCG2AHR | |
| SCHEMBL8080022 | 0.81 | PPARA (0.59) | PPARAPPARDABCG2KDM4EMEN1 | |
| SCHEMBL8080020 | 0.81 | PPARA (0.59) | PPARAPPARDABCG2KDM4EMEN1 | |
| SCHEMBL8087464 | 0.80 | PPARA (0.62) | PPARAPPARDABCG2KDM4EPPARG | |
| SCHEMBL8087469 | 0.80 | PPARA (0.62) | PPARAPPARDABCG2KDM4EPPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106459357-B | Aromatic nitrile-containing compositions for making transparent polythiourethane articles | 科思创德国股份有限公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-106459357-A | Aromatic nitrile-containing compositions for making transparent polythiourethane articles | 科思创德国股份有限公司 | 2017-02-22 | — | — | CN | disclosed |