Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL4557891 | 0.92 | ALDH1A1 (0.44) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL10516 | 0.87 | — | — | |
| SCHEMBL29287853 | 0.85 | ADRB2 (0.41) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| Methane SCHEMBL7217295 | 0.85 | ADRB2 (0.41) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| Ethylene Glycol SCHEMBL7173613 | 0.83 | TSHR (0.48) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| Butyl Alcohol SCHEMBL11138089 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| Acetic Acid Methyl Ester SCHEMBL23929295 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRHPGDATMCES2 | |
| Ethylene SCHEMBL10361479 | 0.80 | TSHR (0.35) | TSHRCES2 | |
| SCHEMBL252597 | 0.79 | THRB (0.39) | TSHR | |
| Di(Hydroxyethyl)Ether SCHEMBL4838428 | 0.77 | TSHR (0.67) | ALDH1A1TSHRCYP3A4MAPK1 |
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-1663916-B1 | METHOD FOR CATALYTIC DEOXYGENATION OF PROCESS FLUIDS OF OLEFIN DIMERIZATION PROCESSES | NESTE OIL OYJ (FI) | 2009-07-01 | — | — | EP | disclosed |