Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.58 |
| ▸ | APP | P05067 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11530814 | 1.00 | NFE2L2 (0.58) | NFE2L2APPRELAPTGS1PTGS2 | |
| SCHEMBL5617807 | 0.87 | APP (0.62) | NFE2L2APPRELAPTGS1PTGS2 | |
| SCHEMBL17311315 | 0.87 | APP (0.62) | NFE2L2APPRELAPTGS1PTGS2 | |
| SCHEMBL699783 | 0.86 | APP (0.64) | NFE2L2APPPTGS1CA1 | |
| SCHEMBL699782 | 0.86 | APP (0.64) | NFE2L2APPPTGS1CA1 | |
| (E)-1,2-Di-P-Tolylethene SCHEMBL1793692 | 0.86 | NFE2L2 (0.74) | NFE2L2RELAPTGS1PTGS2ALOX5 | |
| SCHEMBL318786 | 0.86 | NFE2L2 (0.74) | NFE2L2RELAPTGS1PTGS2ALOX5 | |
| (E)-1,2-Di-P-Tolylethene SCHEMBL1305582 | 0.86 | NFE2L2 (0.74) | NFE2L2RELAPTGS1PTGS2ALOX5 | |
| (E)-1,2-Di-P-Tolylethene SCHEMBL1305580 | 0.86 | NFE2L2 (0.74) | NFE2L2RELAPTGS1PTGS2ALOX5 | |
| SCHEMBL318785 | 0.86 | NFE2L2 (0.74) | NFE2L2RELAPTGS1PTGS2ALOX5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2968440-B1 | CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME | ZYMEWORKS INC (CA) | 2019-06-05 | — | — | EP | disclosed |
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | disclosed |