Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
| ▸ | EZH2 | Q15910 | 2/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL28598243 | 0.92 | CCR5 (0.50) | CCR5EZH2ALDH1A1L3MBTL1MEN1 | |
| SCHEMBL28601010 | 0.90 | EZH2 (0.45) | CCR5EZH2ALDH1A1HTTNPC1 | |
| SCHEMBL28592360 | 0.89 | PARP1 (0.44) | MMP13CCR5EZH2ALDH1A1HTT | |
| SCHEMBL29473806 | 0.85 | EZH2 (0.43) | CCR5EZH2NPC1RAB9A | |
| SCHEMBL29473822 | 0.82 | SMN1; SMN2 (0.52) | EZH2ALDH1A1MEN1KMT2ANR1H4 | |
| SCHEMBL28613717 | 0.82 | SMN1; SMN2 (0.52) | EZH2ALDH1A1MEN1KMT2ANR1H4 | |
| SCHEMBL29473791 | 0.82 | RXRA (0.46) | EZH2NPC1EPHX2RAB9A | |
| SCHEMBL28596693 | 0.82 | EPHX2 (0.52) | EZH2MAPK14EPHX2NR1H4 | |
| SCHEMBL28597396 | 0.81 | CCR5 (0.48) | CCR5EZH2L3MBTL1NPC1EPHX2 | |
| SCHEMBL16935193 | 0.80 | ALDH1A1 (0.47) | CCR5EZH2ALDH1A1HTTMEN1 |
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 |