Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29370486 | 0.87 | PTGS2 (0.46) | CYP1A2ACHEPTGS2MAOAMAOB | |
| SCHEMBL319633 | 0.87 | PTGS2 (0.46) | CYP1A2ACHEPTGS2MAOAMAOB | |
| Lithium SCHEMBL29594699 | 0.85 | PTGS2 (0.44) | CYP1A2ACHEPTGS2MAOAMAOB | |
| Bromide SCHEMBL31108155 | 0.85 | PTGS2 (0.44) | CYP1A2ACHEPTGS2MAOAMAOB | |
| SCHEMBL27420942 | 0.85 | PTGS2 (0.44) | CYP1A2ACHEPTGS2MAOAMAOB | |
| SCHEMBL8737400 | 0.85 | PTGS2 (0.44) | CYP1A2ACHEPTGS2MAOAMAOB | |
| SCHEMBL27490724 | 0.85 | PTGS2 (0.44) | CYP1A2ACHEPTGS2MAOAMAOB | |
| SCHEMBL27185377 | 0.85 | PTGS2 (0.48) | ACHEPTGS2MAOAMAOBMTNR1A | |
| Hydrochloric Acid SCHEMBL7076887 | 0.83 | CYP11B2 (0.43) | CYP1A2ACHEPTGS2MAOAMAOB | |
| Hydrochloric Acid SCHEMBL8030722 | 0.83 | CYP11B2 (0.43) | CYP1A2ACHEPTGS2MAOAMAOB |
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-109715682-A | Polymerization catalyst | 尤尼威蒂恩技术有限责任公司 | 2019-05-03 | — | — | CN | disclosed |