Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL14444061 | 0.79 | ESR1 (0.32) | ESR1ESR2 | |
| SCHEMBL16520314 | 0.78 | ADRB2 (0.42) | TSHR | |
| SCHEMBL22620371 | 0.78 | ESR1 (0.50) | ESR1ESR2 | |
| SCHEMBL15468265 | 0.72 | RIPK1 (0.40) | TRPA1ALDH1A1RIPK1 | |
| SCHEMBL13749369 | 0.71 | LMNA (0.37) | ALDH1A1TSHR | |
| SCHEMBL13742741 | 0.71 | ESR1 (0.41) | ESR1ESR2TRPA1ALDH1A1TSHR | |
| SCHEMBL21475358 | 0.69 | TRPA1 (0.36) | ESR1ESR2TRPA1ALDH1A1TSHR | |
| SCHEMBL190146 | 0.69 | IDO1 (0.52) | TRPA1ALDH1A1TSHR | |
| SCHEMBL7550160 | 0.69 | ESR1 (0.46) | ESR1ESR2TRPA1ALDH1A1TSHR | |
| SCHEMBL13714517 | 0.69 | ESR1 (0.42) | ESR1ESR2TRPA1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20110282009-A1 | Free-radical Curable Isobutylene-rich Polymers | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2011-11-17 | — | — | US | disclosed |