Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 7/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.43 |
| ▸ | CTSV | O60911 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28876964 | 0.82 | CYP1A2 (0.57) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL3239909 | 0.79 | ALOX5 (0.71) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL4515585 | 0.78 | MAOB (0.50) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL31483501 | 0.78 | MAOB (0.50) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL7942817 | 0.77 | CYP3A4 (0.49) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL3156910 | 0.77 | ALOX5 (0.58) | CYP3A4ALOX5MAOBMAOACA12 | |
| SCHEMBL11240186 | 0.77 | EDNRA (0.52) | ALOX5MAOBMAOAP2RY14PPARG | |
| SCHEMBL80829 | 0.76 | MAOB (0.68) | ALOX5MAOBMAOABCHE | |
| SCHEMBL29411728 | 0.76 | MAOB (0.68) | ALOX5MAOBMAOABCHE | |
| SCHEMBL7946154 | 0.76 | LMNA (0.49) | CYP3A4ALOX5MAOBMAOACA12 |
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-110343531-A | A kind of dibenzothiophenes class can poly- property compound and its application | 北京八亿时空液晶科技股份有限公司 | 2019-10-18 | — | — | CN | disclosed |