Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | HPGD | P15428 | 7/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9070 | 0.77 | ALDH1A1 (0.80) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL11550681 | 0.76 | ALDH1A1 (0.70) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8899 | 0.75 | ALDH1A1 (0.58) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL11552900 | 0.73 | ALDH1A1 (0.65) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| Ethylene Glycol SCHEMBL18525379 | 0.73 | MAOA (0.86) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL28202681 | 0.72 | ALDH1A1 (0.41) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL11320297 | 0.72 | KDM4E (0.56) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8154964 | 0.72 | CA1 (0.55) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL2121813 | 0.71 | KDM4E (0.74) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL11479069 | 0.71 | MAOB (0.71) | KDM4EALDH1A1HPGDMAPTHSD17B10 |
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-107903235-A | A kind of isoflavone compound in rose waste residue and preparation method and application | 云南中烟工业有限责任公司 | 2018-04-13 | — | — | CN | disclosed |