Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL21295790 | 0.88 | PTGS2 (0.36) | PTGS2MAPK14 | |
| SCHEMBL28598912 | 0.86 | PTGS2 (0.44) | PTGS2PTPRCBCAT2TP53ALOX15 | |
| SCHEMBL1681771 | 0.76 | PTGS2 (0.65) | PTGS2PTPRCBCAT2MAPK14PTGS1 | |
| Ammonia Solution, Strong SCHEMBL28994523 | 0.74 | PTGS2 (0.62) | PTGS2PTPRCBCAT2MAPK14PTGS1 | |
| Hydrogen Sulfide SCHEMBL27804205 | 0.74 | PTGS2 (0.62) | PTGS2PTPRCBCAT2MAPK14PTGS1 | |
| SCHEMBL2782853 | 0.74 | PTGS2 (0.68) | PTGS2BCAT2MAPK14PTGS1 | |
| SCHEMBL8143233 | 0.74 | MEN1 (0.33) | BCAT2MAPK1KMT2A | |
| SCHEMBL28594300 | 0.74 | PTGS2 (0.54) | PTGS2PTPRCBCAT2MAPK14PTGS1 | |
| SCHEMBL28603928 | 0.74 | PTGS2 (0.54) | PTGS2PTPRCBCAT2MAPK14PTGS1 | |
| SCHEMBL1521830 | 0.74 | CYP2A6 (0.40) | CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109311844-B | Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component | 东曹株式会社 | 2021-07-20 | — | — | CN | disclosed |