Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.54 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.45 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | PLG | P00747 | 1/20 | 0.37 |
| ▸ | PLAT | P00750 | 1/20 | 0.37 |
| ▸ | KLK1 | P06870 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28899852 | 0.92 | AKR1B1 (0.44) | PTGS2CASP1NCOA1NCOA3AKR1B1 | |
| SCHEMBL146565 | 0.85 | CASP1 (0.50) | PTGS2CASP1HTR6CA1CA2 | |
| SCHEMBL502864 | 0.85 | CASP1 (0.50) | PTGS2CASP1HTR6CA1CA2 | |
| SCHEMBL11599660 | 0.83 | CASP1 (0.49) | PTGS2CASP1HTR6CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL502557 | 0.83 | CASP1 (0.49) | PTGS2CASP1HTR6CA1CA2 | |
| Biphenyl SCHEMBL1071653 | 0.82 | HTR6 (0.59) | PTGS2CASP1HTR6KMT2A | |
| SCHEMBL31463127 | 0.79 | AKR1B1 (0.56) | PTGS2CASP1AKR1B1HTR6GAA | |
| SCHEMBL5711493 | 0.77 | PTGS2 (0.52) | PTGS2CASP1AKR1B1HTR6CA1 | |
| SCHEMBL9323437 | 0.76 | HTR6 (0.65) | PTGS2CASP1HTR6LMNAGAA | |
| SCHEMBL11600047 | 0.76 | CASP1 (0.43) | PTGS2CASP1HTR6LMNAGAA |
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-109153781-B | Poly (aryl ether ketone) (PAEK) compositions having low volatile compound content and their use in sintering processes | 阿科玛法国公司 | 2021-11-30 | — | — | CN | disclosed |