Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | CTSC | P53634 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29290747 | 0.87 | CYP2C19 (0.66) | CYP2C19POLBCTSCLMNAPKM | |
| SCHEMBL8623267 | 0.84 | EPHX1 (0.49) | EPHX1CYP2C19POLBPKMSLC6A3 | |
| SCHEMBL27569203 | 0.80 | CYP2C19 (0.49) | EPHX1CYP2C19POLBCTSCLMNA | |
| SCHEMBL7306181 | 0.78 | CYP2C19 (0.50) | CYP2C19POLBCTSCLMNAPKM | |
| SCHEMBL6122797 | 0.78 | CYP2C19 (0.61) | CYP2C19POLBCTSCLMNARAB9A | |
| SCHEMBL2712722 | 0.76 | CYP2C19 (0.59) | CYP2C19POLBCTSCLMNARAB9A | |
| SCHEMBL9943773 | 0.76 | CYP2C19 (0.59) | CYP2C19POLBCTSCLMNARAB9A | |
| SCHEMBL1905227 | 0.76 | CYP2C19 (0.59) | CYP2C19POLBCTSCLMNARAB9A | |
| SCHEMBL2712724 | 0.76 | CYP2C19 (0.59) | CYP2C19POLBCTSCLMNARAB9A | |
| SCHEMBL1516139 | 0.75 | EPHX1 (1.00) | EPHX1POLBPKMALDH1A1SLC1A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113214104-B | Method for synthesizing aromatic acetamide | 浙江工业大学 | 2022-05-24 | — | — | CN | disclosed |
| CN-113214104-A | Method for synthesizing aromatic acetamide | 浙江工业大学 | 2021-08-06 | — | — | CN | disclosed |
| CN-105175392-B | A kind of carboxylic acid compound containing thiophene-structure and amide compound containing thiophene-structure and preparation method thereof | 湖南大学 | 2019-04-19 | — | — | CN | disclosed |