Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.63 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPY2R | P49146 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29950538 | 1.00 | TRPA1 (0.63) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849440 | 0.83 | TRPA1 (0.48) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849427 | 0.82 | SLC6A4 (0.49) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL29950683 | 0.82 | SLC6A4 (0.49) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849438 | 0.82 | MAPT (0.42) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849421 | 0.82 | TRPA1 (0.42) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL29950460 | 0.78 | SLC6A4 (0.44) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849449 | 0.78 | SLC6A4 (0.44) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849431 | 0.73 | TRPA1 (0.41) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 | |
| SCHEMBL28849419 | 0.73 | TRPA1 (0.58) | TRPA1SLC6A2SLC6A4OPRM1OPRD1 |
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-115108875-A | Nitrogen-containing heteroarene chiral cyclic alcohol constructed by visible light asymmetric catalysis, and preparation method and application thereof | 河南师范大学 | 2022-09-27 | — | — | CN | disclosed |