Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4887109 | 0.92 | KDM4E (0.50) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL29611102 | 0.92 | KDM4E (0.50) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL20943654 | 0.91 | TLR8 (0.53) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL5413580 | 0.91 | TLR8 (0.53) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL11269063 | 0.89 | KDM4E (0.44) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL3724371 | 0.88 | KDM4E (0.50) | KDM4EALDH1A1HPGDHSD17B10CYP1A2 | |
| SCHEMBL5713368 | 0.88 | TLR8 (0.51) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL11763792 | 0.87 | KDM4E (0.42) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL14888955 | 0.86 | TLR8 (0.53) | KDM4EALDH1A1HPGDHSD17B10TLR8 | |
| SCHEMBL11148331 | 0.86 | TLR8 (0.53) | KDM4EALDH1A1HPGDHSD17B10TLR8 |
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-109400438-A | One kind 9,10- bis- replaces the synthetic method of luxuriant and rich with fragrance class compound | 西北大学 | 2019-03-01 | — | — | CN | disclosed |