Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.59 |
| ▸ | CASP1 | P29466 | 1/20 | 0.59 |
| ▸ | CASP7 | P55210 | 1/20 | 0.59 |
| ▸ | CASP9 | P55211 | 1/20 | 0.59 |
| ▸ | AURKA | O14965 | 3/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24152475 | 0.91 | EGFR (0.53) | CASP3CASP1CASP7CASP9AURKA | |
| SCHEMBL24151597 | 0.79 | MGAT2 (0.49) | GAAALDH1A1TSHR | |
| SCHEMBL24153266 | 0.78 | NPC1 (0.45) | AURKAAURKBGAAALDH1A1 | |
| SCHEMBL24152342 | 0.77 | NPC1 (0.46) | AURKAAURKBGAAALDH1A1 | |
| SCHEMBL31395806 | 0.76 | CASP3 (1.00) | CASP3CASP1CASP7CASP9GAA | |
| SCHEMBL2486952 | 0.76 | CASP3 (1.00) | CASP3CASP1CASP7CASP9GAA | |
| SCHEMBL7812245 | 0.76 | LRRK2 (0.56) | EGFR | |
| SCHEMBL7812244 | 0.76 | LRRK2 (0.56) | EGFR | |
| SCHEMBL24151592 | 0.75 | CDK2 (0.43) | — | |
| SCHEMBL7982417 | 0.75 | CASP3 (0.61) | CASP3CASP1CASP7CASP9AURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021260722-A1 | DESIGN, SYNTHESIS OF NOVEL OXYINDOLE INHIBITORS OF DENV RNA DEPENDENT RNA POLYMERASE | TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) | 2021-12-30 | — | — | WO | disclosed |