Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.71 |
| ▸ | MAPT | P10636 | 5/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | TP53 | P04637 | 2/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | DPP4 | P27487 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30398224 | 0.88 | MKNK2 (0.73) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL25228726 | 0.86 | ABCG2 (0.78) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL25221559 | 0.84 | ABCG2 (0.88) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| Flavokawain B SCHEMBL25201814 | 0.84 | CYP3A4 (0.74) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL22667449 | 0.83 | ABCG2 (0.82) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL30138773 | 0.83 | ABCG2 (0.82) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL10850463 | 0.83 | ABCG2 (1.00) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL30383114 | 0.83 | ABCG2 (1.00) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL10850468 | 0.83 | ABCG2 (1.00) | ABCG2MAPTCYP3A4KMT2ATP53 | |
| SCHEMBL30397595 | 0.82 | CYP3A4 (0.66) | ABCG2MAPTCYP3A4KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023090908-A1 | NOVEL FLAVONOID DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF METABOLIC DISEASE | 고려대학교 세종산학협력단 | 2023-05-25 | — | — | WO | disclosed |