Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.42 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.42 |
| ▸ | STAT3 | P40763 | 2/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21841323 | 0.86 | CNR2 (0.52) | CNR2ALOX5TUBB1NFKB1TYR | |
| SCHEMBL9743555 | 0.86 | CNR2 (0.52) | CNR2ALOX5TUBB1NFKB1TYR | |
| SCHEMBL9743561 | 0.86 | CNR2 (0.52) | CNR2ALOX5TUBB1NFKB1TYR | |
| SCHEMBL11599639 | 0.77 | CNR2 (0.64) | CNR2ALOX5TUBB1NFE2L2PTGS1 | |
| SCHEMBL3619438 | 0.77 | TUBB1 (0.48) | CNR2ALOX5TUBB1STAT3NFE2L2 | |
| SCHEMBL3619434 | 0.77 | TUBB1 (0.48) | CNR2ALOX5TUBB1STAT3NFE2L2 | |
| SCHEMBL30491036 | 0.75 | TYR (0.65) | ALOX5TUBB1STAT3NFE2L2NFKB1 | |
| SCHEMBL21852875 | 0.75 | TYR (0.65) | ALOX5TUBB1STAT3NFE2L2NFKB1 | |
| SCHEMBL2119058 | 0.75 | TYR (0.65) | ALOX5TUBB1STAT3NFE2L2NFKB1 | |
| SCHEMBL10602315 | 0.75 | TYR (0.65) | ALOX5TUBB1STAT3NFE2L2NFKB1 |
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-2674428-B1 | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2016-04-06 | — | — | EP | disclosed |