Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13836327 | 1.00 | ALDH1A1 (0.56) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13836488 | 0.84 | ALDH1A1 (0.73) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL17635418 | 0.84 | ALDH1A1 (0.73) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13829271 | 0.82 | ALDH1A1 (0.44) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13829255 | 0.82 | ALDH1A1 (0.44) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13837752 | 0.79 | ALDH1A1 (0.57) | ALDH1A1ABCB1KDM4ECYP3A4HPGD | |
| SCHEMBL17635433 | 0.79 | ALDH1A1 (0.57) | ALDH1A1ABCB1KDM4ECYP3A4HPGD | |
| SCHEMBL17635421 | 0.78 | ALDH1A1 (0.56) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13836603 | 0.78 | ALDH1A1 (0.61) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 | |
| SCHEMBL13837887 | 0.78 | ALDH1A1 (0.61) | ALDH1A1ABCB1PRSS1PRSS2PRSS3 |
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-9296717-B2 | Synthesis of C-3 coupled biflavonoids and C-3 coupled biflavonoid analogues | UNIVERSITY OF THE FREE STATE (ZA) | 2016-03-29 | — | — | US | disclosed |