Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 6/20 | 0.61 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.61 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.61 |
| ▸ | FTO | Q9C0B1 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | CA12 | O43570 | 3/20 | 0.61 |
| ▸ | PPARG | P37231 | 3/20 | 0.61 |
| ▸ | CA7 | P43166 | 3/20 | 0.61 |
| ▸ | XDH | P47989 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | NOX4 | Q9NPH5 | 2/20 | 0.61 |
| ▸ | CA2 | P00918 | 2/20 | 0.61 |
| ▸ | IPMK | Q8NFU5 | 2/20 | 0.61 |
| ▸ | IP6K2 | Q9UHH9 | 2/20 | 0.61 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.61 |
| ▸ | BCHE | P06276 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL15635189 | 0.84 | NOX4 (0.79) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| SCHEMBL22107815 | 0.83 | ABCB1 (0.55) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| SCHEMBL18102778 | 0.82 | ABCB1 (0.56) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| SCHEMBL12693921 | 0.80 | ABCG2 (0.62) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| Nonacosane SCHEMBL28207166 | 0.78 | ABCB1 (0.83) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| SCHEMBL28757172 | 0.78 | ADORA3 (0.60) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| Kaempferol SCHEMBL15634534 | 0.77 | MEN1 (0.89) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| SCHEMBL13620318 | 0.77 | MEN1 (0.74) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| Kaempferol SCHEMBL1259228 | 0.76 | MEN1 (1.00) | ABCB1CYP1A1CYP1A2CYP1B1FTO | |
| Kaempferol SCHEMBL30655455 | 0.76 | MEN1 (1.00) | ABCB1CYP1A1CYP1A2CYP1B1FTO |
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-9850221-B2 | Sulfated and unsulfated flavonoid oligomers as cancer therapeutics | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2017-12-26 | — | — | US | disclosed |