Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 11/20 | 0.40 |
| ▸ | CPB1 | P15086 | 4/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | CPA1 | P15085 | 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 | |
|---|---|---|---|---|
| SCHEMBL17859353 | 0.77 | — | — | |
| SCHEMBL5284049 | 0.75 | CPB2 (0.50) | CPB2CPB1CYP3A4SLC7A5CPA1 | |
| SCHEMBL17861407 | 0.75 | HRH4 (0.45) | HRH4HRH3CPB2CPB1CYP3A4 | |
| SCHEMBL5338200 | 0.71 | ADRA2A (0.53) | HRH4HRH3CPB2CPB1ADRA2A | |
| SCHEMBL6664737 | 0.71 | HRH4 (0.52) | HRH4HRH3CPB2CPB1ADRA2A | |
| SCHEMBL625062 | 0.69 | — | — | |
| SCHEMBL13346893 | 0.68 | CPB2 (0.54) | HRH4HRH3CPB2CPB1CYP3A4 | |
| SCHEMBL10079220 | 0.68 | CPB2 (0.54) | HRH4HRH3CPB2CPB1CYP3A4 | |
| SCHEMBL7118973 | 0.66 | — | — | |
| SCHEMBL6647445 | 0.66 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016096589-A1 | SYNTHETIC ENZYME MIMIC BASED ON A HISTIDINE SCAFFOLD | UNILEVER PLC (GB) | 2016-06-23 | — | — | WO | disclosed |
| WO-2016096590-A1 | SYNTHETIC ENZYME MIMIC BASED ON A HISTIDINE SCAFFOLD | UNILEVER PLC (GB) | 2016-06-23 | — | — | WO | disclosed |