Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | PRKACA | P17612 | 2/20 | 0.36 |
| ▸ | CDK8 | P49336 | 2/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.36 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27463283 | 0.75 | PTGS2 (0.55) | PTGS1KIF11 | |
| SCHEMBL21747386 | 0.72 | MEN1 (0.44) | PCSK9KDM4EMAPTXBP1MAPK1 | |
| SCHEMBL21765829 | 0.71 | PCSK9 (0.40) | PCSK9KDRMAP4K4PRKACACDK8 | |
| SCHEMBL28009342 | 0.71 | GABRA1 (0.46) | PTGS1KDM4EMAPTMAPK1ALDH1A1 | |
| SCHEMBL28277444 | 0.70 | PCSK9 (0.45) | PCSK9PTGS1KDRMAP4K4PRKACA | |
| SCHEMBL21747345 | 0.66 | KMT2A (0.39) | PCSK9KIF11KDM4EMAPTALDH1A1 | |
| SCHEMBL11623898 | 0.65 | ESR1 (0.42) | KDRMAP4K4PRKACACDK8MAP2K1 | |
| SCHEMBL8881198 | 0.65 | PCSK9 (0.45) | PCSK9KDRMAP4K4PRKACACDK8 | |
| SCHEMBL9019096 | 0.65 | PCSK9 (0.45) | PCSK9PTGS1KDRMAP4K4PRKACA | |
| SCHEMBL16152323 | 0.65 | PCSK9 (0.45) | PCSK9KDRMAP4K4PRKACACDK8 |
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-1074439-A | A kind of method from the synthetic trifluoromethyl pyrpole compounds of trifluoromethyl oxazolone | SHANGHAI INST ORGANIC CHEM (CN) | 1993-07-21 | — | — | CN | disclosed |