Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | IAPP | P10997 | 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 | |
|---|---|---|---|---|
| SCHEMBL17102377 | 0.84 | GABRA1 (0.46) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL2475390 | 0.78 | GABRA1 (0.56) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL29719025 | 0.78 | GABRA1 (0.56) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL23079390 | 0.77 | GABRA1 (0.44) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL1861164 | 0.75 | ESR1 (0.39) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL5589782 | 0.74 | GABRA1 (0.46) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL5678308 | 0.74 | GABRA1 (0.46) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL14370499 | 0.73 | ERCC1 (0.45) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL45861 | 0.72 | GABRA1 (0.68) | GABRA1GABRB2PRKCIESR1ESR2 | |
| SCHEMBL27837093 | 0.72 | ALDH1A1 (0.42) | TRPA1 |
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-2015051402-A1 | ALKYLATION OF PHENOLIC COMPOUNDS | THE UNIVERSITY OF SYDNEY (AU) | 2015-04-16 | — | — | WO | disclosed |