Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.69 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.49 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.49 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | TEK | Q02763 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28972038 | 0.90 | TLR8 (0.67) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL28754511 | 0.90 | TLR8 (0.67) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL26420666 | 0.88 | TLR8 (0.74) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL31021032 | 0.85 | TLR8 (0.67) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL26128366 | 0.84 | TLR8 (0.66) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL26127884 | 0.84 | TLR8 (0.65) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| SCHEMBL23496982 | 0.82 | TLR8 (1.00) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| Oxalic Acid SCHEMBL28972006 | 0.81 | TLR8 (0.88) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| Hydrochloric Acid SCHEMBL28754494 | 0.81 | TLR8 (0.97) | TLR8ENPP3ENPP1GRM4KCNH2 | |
| Hydrochloric Acid SCHEMBL29642045 | 0.81 | TLR8 (0.97) | TLR8ENPP3ENPP1GRM4KCNH2 |
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-114702442-A | 4- (7-methoxyquinoline-4-yl) -2-methylphenol malonate and preparation method thereof | 北京拓领博泰生物科技有限公司 | 2022-07-05 | — | — | CN | disclosed |