Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.48 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.47 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.47 |
| ▸ | ITGAL | P20701 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GGT1 | P19440 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.43 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11737075 | 0.90 | CYP3A4 (0.48) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL17861490 | 0.81 | CYP3A4 (0.51) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL9924208 | 0.80 | CYP3A4 (0.53) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL1666697 | 0.77 | ALDH1A1 (0.58) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL3378643 | 0.75 | CYP3A4 (0.61) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL11732991 | 0.75 | PDE4A (0.34) | CPB2 | |
| SCHEMBL7383006 | 0.75 | ITGB2 (0.53) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL11321618 | 0.75 | CYP3A4 (0.54) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL163397 | 0.74 | ITGB2 (0.60) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| SCHEMBL17846596 | 0.74 | CYP3A4 (0.64) | CYP3A4SLC7A5ITGB2ICAM1ITGAL |
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 |
|---|---|---|---|---|---|---|---|
| US-4032676-A | MOISTURIZERS | HENKEL & CIE G.M.B.H. (DT) | 1977-06-28 | — | — | US | disclosed |