Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | AGXT | P21549 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.42 |
| ▸ | LOX | P28300 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6344125 | 0.98 | CYP2A6 (0.51) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| Tetrylammonium SCHEMBL6237150 | 0.91 | CYP2A6 (0.44) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL1445507 | 0.85 | CYP2A6 (0.53) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL436458 | 0.84 | CYP2A6 (0.51) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL1444702 | 0.81 | CYP2A6 (0.45) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL4847281 | 0.79 | CYP2A6 (0.56) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL1444257 | 0.78 | CYP2A6 (0.45) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL21400323 | 0.76 | CYP2A6 (0.53) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL27470182 | 0.75 | CYP2A6 (0.56) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL6237741 | 0.75 | CYP2A6 (0.49) | CYP2A6ADRB2ASIC3LOXL2AGXT |
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-2005011613-A2 | COMBINATION OF DEHYDROEPIANDROSTERONE OR DEHYDROEPIANDROSTERONE-SULFATE WITH A LIPOXYGENASE INHIBITOR FOR TREATMENT OF ASTHMA OR CHRONIC OBSTRUCTIVE PULMONARY DISEASE | EPIGENESIS PHARMACEUTICALS LLC (US) | 2005-02-10 | — | — | WO | disclosed |