Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CPA1 | P15085 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 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 | |
|---|---|---|---|---|
| SCHEMBL14394900 | 0.88 | TRPA1 (0.47) | TRPA1ESR1ESR2HPGDALDH1A1 | |
| SCHEMBL14003410 | 0.85 | TRPA1 (0.58) | TRPA1ESR1ESR2TDP1POLB | |
| SCHEMBL11280400 | 0.84 | TRPA1 (0.61) | TRPA1MAOAMAOBCPA1IDO1 | |
| SCHEMBL13003489 | 0.81 | BDKRB2 (0.42) | TRPA1ESR1ESR2HPGDALDH1A1 | |
| SCHEMBL14402660 | 0.81 | TRPA1 (0.52) | TRPA1POLBMAOASLC6A2SLC6A3 | |
| SCHEMBL14402528 | 0.79 | LDHA (0.50) | POLBIDO1 | |
| SCHEMBL11141534 | 0.79 | MME (0.44) | TRPA1CPA1 | |
| SCHEMBL13996975 | 0.78 | TRPA1 (0.59) | TRPA1HPGDMAOAMAOBCPA1 | |
| SCHEMBL11477092 | 0.77 | ESR1 (0.51) | ESR1ESR2ALDH1A1LMNASLC6A2 | |
| SCHEMBL14402399 | 0.77 | TRPA1 (0.48) | TRPA1ESR1ESR2HPGDALDH1A1 |
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-1847533-A1 | SIX-MEMBERED HETEROCYCLIC COMPOUND AND THE USE THEREOF | Asahi Kasei Pharma Corporation (JP) | 2007-10-24 | — | — | EP | disclosed |