Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Benzothiophene SCHEMBL15227137 | 0.83 | CTNNB1 (0.43) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL28493798 | 0.83 | CYP2A6 (0.51) | CYP2A6ALDH1A1CTNNB1WNT3ACA12 | |
| Benzothiophene SCHEMBL28112179 | 0.82 | CYP2A6 (0.47) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL30395947 | 0.82 | CYP2A6 (0.47) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL28030266 | 0.82 | CYP2A6 (0.47) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL28882160 | 0.82 | CYP2A6 (0.47) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL28758675 | 0.81 | CTNNB1 (0.46) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL4378682 | 0.81 | CTNNB1 (0.46) | CYP2A6CTNNB1WNT3ACA12CA9 | |
| Benzothiophene SCHEMBL7023 | 0.81 | — | — | |
| Benzothiophene SCHEMBL253491 | 0.81 | CA12 (0.42) | CYP2A6ALDH1A1CTNNB1WNT3ACA12 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102690256-B | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2013-09-04 | — | — | CN | claimed |
| CN-102690256-A | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2012-09-26 | — | — | CN | claimed |
| CN-102690256-B | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2013-09-04 | — | — | CN | disclosed |
| CN-102690256-B | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2013-09-04 | — | — | CN | disclosed |
| CN-102690256-B | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2013-09-04 | — | — | CN | disclosed |
| CN-102690256-A | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2012-09-26 | — | — | CN | disclosed |
| CN-102690256-A | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2012-09-26 | — | — | CN | disclosed |
| CN-102690256-A | Phenyl benzothiophene ketone compound and preparation method and application thereof | UNIV SHANXI | 2012-09-26 | — | — | CN | disclosed |