Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 8/20 | 0.77 |
| ▸ | NFKB2 | Q00653 | 8/20 | 0.77 |
| ▸ | RELA | Q04206 | 8/20 | 0.77 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | ODC1 | P11926 | 4/20 | 0.47 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 1/20 | 0.42 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.42 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.42 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.42 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.42 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.42 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.42 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.42 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28904351 | 1.00 | NFKB1 (0.77) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL29271159 | 0.87 | NFKB1 (1.00) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL29271162 | 0.87 | NFKB1 (1.00) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL28495318 | 0.83 | NFKB1 (0.84) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL28495320 | 0.83 | NFKB1 (0.84) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL29271161 | 0.83 | NFKB1 (0.70) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL29271160 | 0.83 | NFKB1 (0.70) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL28491729 | 0.82 | NFKB1 (0.64) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL31376237 | 0.82 | NFKB1 (0.69) | NFKB1NFKB2RELAACHEODC1 | |
| SCHEMBL28489290 | 0.81 | NFKB1 (0.71) | NFKB1NFKB2RELAACHEODC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112047917-A | Xanthohumol derivative and preparation method and application thereof | 中国科学院新疆理化技术研究所 | 2020-12-08 | — | — | CN | claimed |
| CN-112047917-B | Xanthohumol derivative and preparation method and application thereof | 中国科学院新疆理化技术研究所 | 2023-10-31 | — | — | CN | disclosed |
| CN-112047917-A | Xanthohumol derivative and preparation method and application thereof | 中国科学院新疆理化技术研究所 | 2020-12-08 | — | — | CN | disclosed |