Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JUN | P05412 | 4/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.39 |
| ▸ | RELA | Q04206 | 4/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 10/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | MAT2A | P31153 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28987576 | 1.00 | JUN (0.39) | JUNNFKB1NFKB2RELASCN9A | |
| SCHEMBL28987633 | 0.81 | CDK5 (0.50) | GSK3B | |
| SCHEMBL30337215 | 0.81 | CDK5 (0.50) | GSK3B | |
| SCHEMBL31105691 | 0.78 | SCN9A (0.44) | JUNNFKB1NFKB2RELASCN9A | |
| SCHEMBL24900711 | 0.74 | EGFR (0.42) | JUNNFKB1NFKB2RELASCN9A | |
| SCHEMBL30957515 | 0.74 | EGFR (0.42) | JUNNFKB1NFKB2RELASCN9A | |
| SCHEMBL30221531 | 0.72 | EGFR (0.51) | — | |
| SCHEMBL24900406 | 0.72 | EGFR (0.51) | — | |
| SCHEMBL17683181 | 0.72 | ALDH1A1 (0.40) | SCN9AGSK3B | |
| SCHEMBL24900483 | 0.71 | PDK1 (0.42) | SCN9AGSK3B |
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-115974845-A | Preparation method of oxitinib intermediate | 奥锐特药业股份有限公司 | 2023-04-18 | — | — | CN | disclosed |