Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.38 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.38 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.38 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CTSV | O60911 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16138106 | 0.87 | DAO (0.53) | DAOPARP1ALOX5GRIA1GRIA2 | |
| Tert-Butyl Formate SCHEMBL28043666 | 0.80 | ALOX5 (0.43) | PARP1ALOX5CA12CA9TDP1 | |
| SCHEMBL17875305 | 0.76 | CA12 (0.56) | DAOPARP1ALOX5GRIA1GRIA2 | |
| SCHEMBL6220590 | 0.73 | ALDH1A1 (0.44) | DAOPARP1ALOX5GRIA1GRIA2 | |
| SCHEMBL8834687 | 0.72 | KDM4E (0.53) | DAOPARP1GRIA1GRIA2GRIA3 | |
| SCHEMBL28341203 | 0.72 | PKM (0.44) | DAOPARP1GRIA1GRIA2GRIA3 | |
| SCHEMBL30057694 | 0.69 | DAO (0.46) | DAOPARP1GRIA1GRIA2GRIA3 | |
| Tert-Butyl Formate SCHEMBL28816878 | 0.69 | CYP2A6 (0.42) | GRIA1GRIA2GRIA3GRIA4L3MBTL1 | |
| Tert-Butyl Formate SCHEMBL27967197 | 0.69 | MAPT (0.49) | L3MBTL1CA12CA9ALDH1A1SMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL28007058 | 0.69 | MAPT (0.49) | L3MBTL1CA12CA9ALDH1A1SMN1; SMN2 |
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-105164122-A | Substituted oxopyridine derivatives and their use in the treatment of cardiovascular disorders | Bayer Pharma AG | 2015-12-16 | — | — | CN | disclosed |