Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | POR | P16435 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL900437 | 0.85 | TRPA1 (0.44) | ESR1ESR2HTTHSD17B1BACE1 | |
| SCHEMBL18648071 | 0.82 | TRPA1 (0.52) | ESR1ESR2AMY1APKMCNR1 | |
| SCHEMBL383087 | 0.81 | ESR1 (0.64) | ESR1ESR2HTTHSD17B1BACE1 | |
| SCHEMBL29587240 | 0.81 | ESR1 (0.64) | ESR1ESR2HTTHSD17B1BACE1 | |
| SCHEMBL899482 | 0.81 | ESR1 (0.68) | ESR1ESR2PKMCNR1GPR55 | |
| SCHEMBL13592688 | 0.78 | ESR1 (0.78) | ESR1ESR2HTTBACE1TDP1 | |
| SCHEMBL18348575 | 0.78 | ESR1 (0.52) | ESR1ESR2HTTHSP90AA1TP53 | |
| SCHEMBL13400895 | 0.78 | CSNK2A1 (0.60) | ESR1ESR2HTTPKMTDP1 | |
| SCHEMBL12924695 | 0.78 | ESR1 (0.50) | ESR1ESR2PKMCNR1GPR55 | |
| SCHEMBL12440907 | 0.77 | SRC (0.38) | ESR1ESR2HTTPKMCNR1 |
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-2012042058-A1 | IMPACT RESISTANCE MODIFIERS FOR EPOXY RESIN COMPOSITIONS | SIKA TECHNOLOGY AG (CH) | 2012-04-05 | — | — | WO | disclosed |