Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 4/20 | 0.64 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.64 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.46 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8048240 | 0.87 | DHODH (0.71) | DHODHTRPM8CLCN2TRPA1ALDH1A1 | |
| SCHEMBL8048243 | 0.87 | DHODH (0.71) | DHODHTRPM8CLCN2TRPA1ALDH1A1 | |
| SCHEMBL21470162 | 0.83 | DHODH (0.68) | DHODHTRPM8TRPA1ALDH1A1MAPT | |
| SCHEMBL8048868 | 0.82 | TRPM8 (0.76) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| SCHEMBL8048873 | 0.82 | TRPM8 (0.76) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| SCHEMBL29966740 | 0.82 | TRPM8 (0.76) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| SCHEMBL8060484 | 0.82 | DHODH (0.70) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| SCHEMBL8060487 | 0.82 | DHODH (0.70) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| SCHEMBL8060378 | 0.81 | TRPM8 (0.74) | DHODHTRPM8TRPA1GRIK1TAS2R14 | |
| Lithium SCHEMBL8048874 | 0.81 | TRPM8 (0.74) | DHODHTRPM8TRPA1GRIK1TAS2R14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019196714-A1 | N-SUBSTITUTED ACRYLAMIDE DERIVATIVE AS DHODH INHIBITOR, AND PREPARATION AND USE THEREOF | 华东理工大学 | 2019-10-17 | — | — | WO | disclosed |