Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 10/20 | 0.83 |
| ▸ | NFKB2 | Q00653 | 10/20 | 0.83 |
| ▸ | RELA | Q04206 | 10/20 | 0.83 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.48 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14249291 | 0.93 | NFKB1 (0.78) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL14249292 | 0.93 | NFKB1 (0.78) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL17583534 | 0.87 | NFKB1 (0.70) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL16166082 | 0.87 | NFKB1 (0.70) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL16174031 | 0.86 | NFKB1 (0.68) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL16166215 | 0.82 | NFKB1 (0.63) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL16166213 | 0.82 | NFKB1 (0.63) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL14296455 | 0.77 | ACHE (0.70) | NFKB1NFKB2RELATDP1ABCG2 | |
| SCHEMBL31376266 | 0.77 | ACHE (0.70) | NFKB1NFKB2RELATDP1ABCG2 | |
| Xanthohumol B SCHEMBL12961703 | 0.76 | NFKB1 (0.56) | NFKB1NFKB2RELATDP1ABCG2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119569692-A | Xanthohumol derivative in hops, and preparation method and application thereof | 中国科学院新疆理化技术研究所 | 2025-03-07 | — | — | CN | disclosed |