Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 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 | |
|---|---|---|---|---|
| SCHEMBL15277280 | 0.80 | TSHR (0.42) | AOC3THRBTAAR1KMT2AALDH1A1 | |
| SCHEMBL825973 | 0.80 | AOC3 (0.50) | AOC3TAAR1ALDH1A1ADRA2AADRA2C | |
| SCHEMBL12669503 | 0.78 | LMNA (0.39) | AOC3THRBTAAR1KMT2AEPHX1 | |
| SCHEMBL17084095 | 0.76 | ADRA2C (0.48) | AOC3TAAR1KMT2AALDH1A1ADRA2A | |
| SCHEMBL15222220 | 0.76 | ADRA2C (0.48) | AOC3TAAR1KMT2AALDH1A1ADRA2A | |
| SCHEMBL25039979 | 0.76 | THRB (0.42) | THRBTAAR1KMT2AALDH1A1EPHX1 | |
| SCHEMBL17084088 | 0.76 | ADRA2C (0.48) | AOC3TAAR1KMT2AALDH1A1ADRA2A | |
| SCHEMBL17084114 | 0.76 | ADRA2C (0.48) | AOC3TAAR1KMT2AALDH1A1ADRA2A | |
| SCHEMBL25082860 | 0.76 | THRB (0.42) | THRBTAAR1KMT2AALDH1A1EPHX1 | |
| SCHEMBL609266 | 0.76 | THRB (0.42) | THRBTAAR1KMT2AALDH1A1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5278335-A | Preparation of aryl-substituted aliphatic carboxylic acid esters by catalytic carbonylation | ETHYL CORPORATION (US) | 1994-01-11 | — | — | US | disclosed |