Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 10/20 | 0.39 |
| ▸ | CASP7 | P55210 | 10/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.35 |
| ▸ | CASP6 | P55212 | 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 | |
|---|---|---|---|---|
| SCHEMBL24152504 | 0.91 | TAS2R14 (0.41) | TRPA1TAS2R14CASP3MAOAKCNA5 | |
| SCHEMBL24151567 | 0.87 | TRPA1 (0.55) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24152371 | 0.86 | TRPA1 (0.41) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24153270 | 0.85 | TRPA1 (0.39) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24152493 | 0.83 | PTGS1 (0.37) | TRPA1CA1CA2TAS2R14CASP3 | |
| SCHEMBL24152438 | 0.83 | TRPA1 (0.37) | TRPA1CA12CA1CA2CA9 | |
| SCHEMBL24153265 | 0.83 | TRPA1 (0.37) | TRPA1TAS2R14CASP3CASP7MAOA | |
| SCHEMBL24152481 | 0.82 | ALDH1A1 (0.40) | TRPA1TAS2R14CASP3CASP7 | |
| SCHEMBL24153256 | 0.82 | TRPA1 (0.37) | TRPA1TAS2R14CASP3CASP7MAOA | |
| SCHEMBL24152818 | 0.81 | TRPA1 (0.34) | TRPA1CA1CA2TAS2R14CASP3 |
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 |