Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 4/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 3/20 | 0.36 |
| ▸ | THRA | P10827 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21541035 | 0.72 | ALDH1A1 (0.34) | TSHRCES2CES1ALDH1A1 | |
| SCHEMBL13636953 | 0.71 | ALDH1A1 (0.34) | TSHRCES2CES1ALDH1A1 | |
| SCHEMBL8973562 | 0.70 | DGKA (0.49) | TSHRNAAADGKACES2DNM1 | |
| SCHEMBL27917760 | 0.70 | TSHR (0.39) | TSHRNAAACES2HCAR2EPHX1 | |
| SCHEMBL8997124 | 0.70 | TSHR (0.39) | TSHRNAAACES2HCAR2EPHX1 | |
| Acrolein SCHEMBL9699770 | 0.69 | TSHR (0.39) | TSHRNAAACES2HCAR2EPHX1 | |
| SCHEMBL19882382 | 0.69 | ALDH1A1 (0.41) | TSHRNAAACES2CES1ALDH1A1 | |
| SCHEMBL22621253 | 0.69 | TSHR (0.38) | TSHRCES2CES1ALDH1A1 | |
| SCHEMBL19134014 | 0.68 | NAAA (0.50) | TSHRNAAADGKACES2HCAR2 | |
| SCHEMBL9837471 | 0.68 | DGKA (0.46) | TSHRNAAADGKACES2DNM1 |
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-3770257-A1 | BBB-PASSING LIPID LIGAND OF HETERO NUCLEIC ACID | National University Corporation Tokyo Medical and Dental University (JP) | 2021-01-27 | — | — | EP | disclosed |