Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | BLM | P54132 | 2/20 | 0.53 |
| ▸ | GFER | P55789 | 2/20 | 0.53 |
| ▸ | KDM5A | P29375 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | OGG1 | O15527 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9921286 | 0.79 | MPO (0.61) | MPOCYP3A4BLMGFERKDM5A | |
| SCHEMBL2678949 | 0.78 | MPO (0.80) | MPOCYP3A4BLMGFERKDM5A | |
| SCHEMBL343630 | 0.78 | MPO (0.80) | MPOCYP3A4BLMGFERKDM5A | |
| SCHEMBL28188923 | 0.76 | MPO (0.76) | MPOCYP3A4BLMGFERKDM5A | |
| SCHEMBL28819400 | 0.75 | TSHR (0.55) | ALDH1A1MAPTCA1CA2CA9 | |
| Methylhydrazine SCHEMBL27911721 | 0.75 | RAB9A (0.51) | ALDH1A1MAPTL3MBTL1CA1CA2 | |
| Hydrazine SCHEMBL27929787 | 0.74 | RAB9A (0.54) | ALDH1A1MAPTL3MBTL1CA1CA2 | |
| Methane SCHEMBL9490009 | 0.72 | ALDH1A1 (0.39) | ALDH1A1MAPTCA1CA2CA9 | |
| SCHEMBL11134828 | 0.72 | MPO (0.70) | MPOCYP3A4BLMGFERKDM5A | |
| SCHEMBL752600 | 0.72 | MPO (0.70) | MPOCYP3A4BLMGFERKDM5A |
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-109689627-B | Pyrazolylquinoline compounds, process for their preparation and pharmaceutical compositions containing them | 高雄医学大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-113968857-A | Isochrysine analogue prepared from enoxacin as raw material and preparation method and application thereof | 郑州工业应用技术学院 | 2022-01-25 | — | — | CN | disclosed |