Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA9 | Q16790 | 3/20 | 0.52 |
| ▸ | GRM5 | P41594 | 15/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28516002 | 0.87 | CA12 (0.55) | CA12CA2CA9GRM5CA1 | |
| SCHEMBL28355385 | 0.82 | GRM5 (0.47) | CA12CA2CA9GRM5CA1 | |
| SCHEMBL28353632 | 0.81 | LMNA (0.37) | CA12CA2CA9GRM5MEN1 | |
| SCHEMBL28355913 | 0.81 | NPC1 (0.50) | CA12CA2CA9GRM5MEN1 | |
| SCHEMBL28906615 | 0.81 | GRM5 (0.41) | CA12CA2CA9GRM5MEN1 | |
| SCHEMBL28528729 | 0.81 | GRM5 (0.49) | GRM5MEN1MAPTRAB9AKMT2A | |
| SCHEMBL14998080 | 0.78 | ALDH1A1 (0.35) | GRM5MEN1MAPTRAB9AKMT2A | |
| SCHEMBL29700306 | 0.78 | ALDH1A1 (0.35) | GRM5MEN1MAPTRAB9AKMT2A | |
| SCHEMBL9302636 | 0.76 | CA12 (0.62) | CA12CA2CA9GRM5CA1 | |
| SCHEMBL31286312 | 0.76 | CA12 (0.62) | CA12CA2CA9GRM5CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110656346-A | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2020-01-07 | — | — | CN | claimed |
| CN-110656346-B | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2021-02-02 | — | — | CN | disclosed |
| CN-110656346-A | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2020-01-07 | — | — | CN | disclosed |
| CN-110483475-A | A kind of method that silver oxide catalysis method prepares benzothiophenes | UNIV SHAOXING | 2019-11-22 | — | — | CN | disclosed |