Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | HTR2B | P41595 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HRH1 | P35367 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL50784 | 0.82 | LMNA (0.56) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| Isothymol SCHEMBL852892 | 0.82 | LMNA (0.68) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL7758863 | 0.80 | LMNA (0.54) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL13257345 | 0.79 | TRPA1 (0.56) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL24299898 | 0.78 | LMNA (0.52) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL11075829 | 0.78 | KDM4E (0.47) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| Isothymol SCHEMBL11039381 | 0.78 | LMNA (0.63) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL9198019 | 0.78 | LMNA (0.52) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL23049815 | 0.77 | ALDH1A1 (0.41) | LMNACHRM1ADRA1ATRPA1SLC6A2 | |
| SCHEMBL218020 | 0.77 | TRPA1 (0.54) | LMNACHRM1ADRA1ATRPA1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2332909-B1 | HYDROXYBENZAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF HSP90 | ASTEX THERAPEUTICS LTD (GB) | 2014-10-15 | — | — | EP | disclosed |