Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24152464 | 0.89 | TRPA1 (0.41) | TRPA1CASP3ALDH1A1LMNAMEN1 | |
| SCHEMBL24152517 | 0.85 | TRPA1 (0.48) | TRPA1ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL24152359 | 0.83 | TRPA1 (0.50) | TRPA1CASP3CA12CA2CA9 | |
| SCHEMBL24152529 | 0.83 | TRPA1 (0.45) | TRPA1CASP3 | |
| SCHEMBL24152368 | 0.82 | TRPA1 (0.45) | TRPA1CASP3ALDH1A1KMT2AMAPT | |
| SCHEMBL24152382 | 0.81 | TRPA1 (0.44) | TRPA1ALDH1A1LMNAKMT2AMAPT | |
| SCHEMBL24151587 | 0.81 | TRPA1 (0.42) | TRPA1CASP3ALDH1A1LMNAMEN1 | |
| SCHEMBL24152377 | 0.81 | TRPA1 (0.48) | TRPA1CASP3ALDH1A1LMNAMEN1 | |
| SCHEMBL24152357 | 0.81 | TRPA1 (0.54) | TRPA1CASP3CA12CA2CA9 | |
| SCHEMBL24152360 | 0.81 | TRPA1 (0.43) | TRPA1CASP3 |
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 |