Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.45 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.44 |
| ▸ | LOX | P28300 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL436458 | 0.82 | CYP2A6 (0.51) | AGXTCYP2A6ASIC3LOXL2ALOX5 | |
| SCHEMBL9539704 | 0.80 | ALOX5 (0.44) | ALOX5HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9538848 | 0.79 | GAA (0.43) | ALOX5GAAHDAC3HDAC4HDAC1 | |
| SCHEMBL2396391 | 0.79 | CYP2A6 (0.54) | AGXTCYP2A6ASIC3LOXL2ALOX5 | |
| SCHEMBL10736150 | 0.77 | AGXT (0.65) | AGXTCYP2A6ASIC3LOXL2ADRB2 | |
| SCHEMBL9584912 | 0.76 | CYP2E1 (0.45) | CYP2A6ALOX5HDAC3HDAC1HDAC2 | |
| SCHEMBL5319433 | 0.76 | AGXT (0.72) | AGXTCYP2A6ASIC3LOXL2ADRB2 | |
| SCHEMBL9539676 | 0.76 | ALOX5 (0.50) | AGXTCYP2A6ASIC3LOXL2ALOX5 | |
| SCHEMBL9542445 | 0.75 | SLC1A3 (0.50) | ALOX5GAA | |
| SCHEMBL9539825 | 0.74 | ALOX5 (0.39) | ALOX5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993003719-A1 | ARYLALKYLETHER AND ARYLALKYLTHIOETHER INHIBITORS OF LIPOXYGENASE ENZYME ACTIVITY | ABBOTT LABORATORIES (US) | 1993-03-04 | — | — | WO | claimed |
| WO-1993003719-A1 | ARYLALKYLETHER AND ARYLALKYLTHIOETHER INHIBITORS OF LIPOXYGENASE ENZYME ACTIVITY | ABBOTT LABORATORIES (US) | 1993-03-04 | — | — | WO | disclosed |
| US-5183818-A | Also for inhibiting leukotriene biosynthesis | ABBOTT LABORATORIES (US) | 1993-02-02 | — | — | US | disclosed |