Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 6/20 | 0.61 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | MMP12 | P39900 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17136474 | 1.00 | TRPA1 (0.61) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17199918 | 0.93 | TRPA1 (0.64) | TRPA1MMP8MMP12MMP13ALDH1A1 | |
| SCHEMBL17199902 | 0.92 | TRPA1 (0.58) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17136379 | 0.92 | TRPA1 (0.52) | TRPA1MMP8MMP12MMP13ALDH1A1 | |
| SCHEMBL17199895 | 0.91 | TRPA1 (0.54) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17199887 | 0.91 | TRPA1 (0.56) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17136418 | 0.91 | MMP8 (0.54) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17136513 | 0.91 | MMP8 (0.53) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17136492 | 0.91 | TRPA1 (0.53) | TRPA1MMP1ADAM17MMP8MMP12 | |
| SCHEMBL17199908 | 0.90 | TRPA1 (0.60) | TRPA1MMP1ADAM17MMP8MMP12 |
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-2937335-A1 | HETEROCYCLIC AMIDE DERIVATIVE, AND MEDICINE CONTAINING SAME | Ajinomoto Co., Inc. (JP) | 2015-10-28 | — | — | EP | disclosed |