Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 2/20 | 0.30 |
| ▸ | CASP7 | P55210 | 2/20 | 0.30 |
| ▸ | CASP6 | P55212 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL24152847 | 0.90 | TRPA1 (0.41) | TRPA1PTGS1PTGS2CASP3CASP7 | |
| SCHEMBL24152357 | 0.86 | TRPA1 (0.54) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24151764 | 0.86 | TRPA1 (0.49) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24152362 | 0.86 | TRPA1 (0.53) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24152517 | 0.85 | TRPA1 (0.48) | TRPA1MAPK1 | |
| SCHEMBL24152372 | 0.83 | TRPA1 (0.47) | TRPA1CA12CA2CA9MAPK1 | |
| SCHEMBL24151575 | 0.82 | TRPA1 (0.61) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24152529 | 0.82 | TRPA1 (0.45) | TRPA1CASP3 | |
| SCHEMBL24152377 | 0.80 | TRPA1 (0.48) | TRPA1MAPK1CASP3 | |
| SCHEMBL24151587 | 0.80 | TRPA1 (0.42) | TRPA1MAPK1CASP3CASP7 |
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 |