Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | ADH1B | P00325 | 1/20 | 0.52 |
| ▸ | ADH1C | P00326 | 1/20 | 0.52 |
| ▸ | ADH1A | P07327 | 1/20 | 0.52 |
| ▸ | ADH4 | P08319 | 1/20 | 0.52 |
| ▸ | ADH7 | P40394 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | FAAH | O00519 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 4/20 | 0.48 |
| ▸ | PPARD | Q03181 | 4/20 | 0.48 |
| ▸ | PPARA | Q07869 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Decane SCHEMBL28167744 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Octane SCHEMBL27841063 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Undecane SCHEMBL27602336 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Heptane SCHEMBL9572062 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Nonane SCHEMBL27783272 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Formic Acid SCHEMBL28813257 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Decane SCHEMBL30414302 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Octane SCHEMBL2485910 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Dodecane SCHEMBL28752290 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Dodecane SCHEMBL27955182 | 0.97 | TSHR (0.55) | TSHRTHRBEPHX1ADH1BADH1C |
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-110382679-A | Interaction mechanism of urea/solid acid under storage conditions and storage stable solid composition comprising urea and acid | 埃科莱布美国股份有限公司 | 2019-10-25 | — | — | CN | disclosed |