Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABHD6 | Q9BV23 | 3/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 7/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.37 |
| ▸ | CCR3 | P51677 | 2/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22311101 | 0.89 | NR1H2 (0.44) | ABHD6NR1H2NR1H3CCR3HRH1 | |
| SCHEMBL20060838 | 0.87 | ABHD6 (0.36) | ABHD6FFAR4NR1H2NR1H3MGLL | |
| SCHEMBL20077389 | 0.87 | NR1H2 (0.38) | FFAR4NR1H2NR1H3SLC6A9PDK2 | |
| SCHEMBL20068703 | 0.83 | NR1H2 (0.51) | ABHD6FFAR4NR1H2NR1H3CCR3 | |
| SCHEMBL20060823 | 0.83 | NR1H2 (0.51) | ABHD6FFAR4NR1H2NR1H3CCR3 | |
| SCHEMBL30451002 | 0.83 | NR1H2 (0.51) | ABHD6FFAR4NR1H2NR1H3CCR3 | |
| SCHEMBL25547094 | 0.83 | FFAR4 (0.41) | ABHD6FFAR4NR1H2NR1H3CCR3 | |
| SCHEMBL20068593 | 0.83 | GPR119 (0.47) | ABHD6FFAR4MGLLFAAH | |
| SCHEMBL20068695 | 0.81 | HCRTR1 (0.36) | NR1H2NR1H3SLC6A9P2RX7 | |
| SCHEMBL20060866 | 0.80 | GPR119 (0.44) | NR1H2NR1H3PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018071317-A1 | ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |