Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EZH2 | Q15910 | 15/20 | 0.45 |
| ▸ | EZH1 | Q92800 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | PRKX | P51817 | 1/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29473806 | 0.95 | EZH2 (0.43) | EZH2EZH1NPC1RAB9ACCR5 | |
| SCHEMBL29473791 | 0.91 | RXRA (0.46) | EZH2EZH1NPC1RAB9ARXRA | |
| SCHEMBL28919197 | 0.91 | RXRA (0.46) | EZH2EZH1NPC1RAB9ARXRA | |
| SCHEMBL28598409 | 0.90 | MMP13 (0.45) | EZH2NPC1RAB9AALDH1A1HTT | |
| SCHEMBL28598243 | 0.90 | CCR5 (0.50) | EZH2NPC1RAB9AALDH1A1CCR5 | |
| SCHEMBL28592360 | 0.89 | PARP1 (0.44) | EZH2EZH1NPC1RAB9AALDH1A1 | |
| SCHEMBL29473822 | 0.88 | SMN1; SMN2 (0.52) | EZH2EZH1ALDH1A1 | |
| SCHEMBL28613717 | 0.88 | SMN1; SMN2 (0.52) | EZH2EZH1ALDH1A1 | |
| SCHEMBL28607253 | 0.86 | ALDH1A1 (0.43) | EZH2NPC1RAB9AALDH1A1HTT | |
| SCHEMBL28601006 | 0.83 | EPHX2 (0.49) | EZH2EZH1ROCK2ROCK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113045494-B | Pyridone derivative and application thereof in preparation of drugs for preventing and/or treating tuberculosis caused by mycobacterium tuberculosis | 四川大学华西医院 | 2022-04-26 | — | — | CN | disclosed |
| CN-113045494-A | Pyridone derivative and application thereof in preparation of drugs for preventing and/or treating tuberculosis caused by mycobacterium tuberculosis | 四川大学华西医院 | 2021-06-29 | — | — | CN | disclosed |