Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | LMNA | P02545 | 3/20 | 0.66 |
| ▸ | HPGD | P15428 | 3/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | SCN1A | P35498 | 1/20 | 0.66 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.66 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.66 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | GHSR | Q92847 | 1/20 | 0.66 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.66 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 3/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL28337139 | 0.91 | KDM4E (0.71) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL28337145 | 0.88 | ALDH1A1 (0.67) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL23722827 | 0.87 | KDM4E (0.82) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL28339324 | 0.85 | MEN1 (0.68) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL9203821 | 0.83 | KDM4E (0.64) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL14530176 | 0.82 | KDM4E (0.74) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL28339271 | 0.81 | ALDH1A1 (0.83) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL23722877 | 0.81 | KDM4E (0.90) | KDM4EALDH1A1LMNAHPGDGAA | |
| SCHEMBL10648452 | 0.80 | HTR3E (0.56) | KDM4EALDH1A1LMNAHPGDGAA | |
| Dibucaine SCHEMBL34473 | 0.80 | KDM4E (1.00) | KDM4EALDH1A1LMNAHPGDGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110590660-B | Quinoline carboxamide compound, preparation method thereof and application of quinoline carboxamide compound in resisting enterovirus 71 | 武汉大学 | 2021-02-19 | — | — | CN | claimed |
| CN-110590660-A | Quinoline carboxamide compound, preparation method thereof and application of quinoline carboxamide compound in resisting enterovirus 71 | 武汉大学 | 2019-12-20 | — | — | CN | claimed |
| CN-110590660-B | Quinoline carboxamide compound, preparation method thereof and application of quinoline carboxamide compound in resisting enterovirus 71 | 武汉大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-110590660-A | Quinoline carboxamide compound, preparation method thereof and application of quinoline carboxamide compound in resisting enterovirus 71 | 武汉大学 | 2019-12-20 | — | — | CN | disclosed |