Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6473888 | 0.79 | TRPA1 (0.52) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL6478746 | 0.79 | TRPA1 (0.52) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL9421889 | 0.79 | TRPA1 (0.48) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL6473879 | 0.79 | TRPA1 (0.52) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL28232705 | 0.79 | TRPA1 (0.58) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL1715678 | 0.76 | SLC6A2 (0.48) | TRPA1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL2032921 | 0.76 | CYP1A2 (0.47) | TRPA1CYP1A2 | |
| SCHEMBL17093338 | 0.76 | CYP1A2 (0.47) | TRPA1CYP1A2 | |
| Benzoic Acid SCHEMBL1070689 | 0.76 | TSHR (0.52) | TRPA1CYP1A2 | |
| SCHEMBL8670401 | 0.76 | TRPA1 (0.46) | TRPA1TAAR1SLC6A2SIGMAR1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102757062-A | Method for extracting boron from magnesium-containing saline lake bittern | UNIV ZHEJIANG | 2012-10-31 | — | — | CN | disclosed |