Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18801032 | 0.78 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL22560051 | 0.78 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL18946038 | 0.76 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL15274200 | 0.75 | — | — | |
| SCHEMBL1082420 | 0.75 | — | — | |
| SCHEMBL1068232 | 0.75 | — | — | |
| SCHEMBL7012240 | 0.73 | TRPA1 (0.35) | TRPA1MAPK1ALDH1A1 | |
| SCHEMBL7012251 | 0.73 | TRPA1 (0.35) | TRPA1MAPK1ALDH1A1 | |
| SCHEMBL6895461 | 0.73 | — | — | |
| SCHEMBL14907633 | 0.73 | — | — |
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-2009109991-A2 | NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS | SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) | 2009-09-11 | — | — | WO | disclosed |