Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.68 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.41 |
| ▸ | IAPP | P10997 | 4/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL199730 | 0.82 | GABRA1 (1.00) | GABRA1GABRB2CA2IAPPPTPN5 | |
| SCHEMBL6990892 | 0.82 | ALDH1A1 (0.48) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL11029713 | 0.82 | GAA (0.53) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL5120337 | 0.82 | GABRA1 (0.71) | GABRA1GABRB2GAAHMGB1PTPN5 | |
| SCHEMBL2590889 | 0.81 | GABRA1 (0.44) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL7454433 | 0.80 | MMP2 (0.47) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL431188 | 0.80 | GABRA1 (0.45) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL2820614 | 0.79 | GABRA1 (0.48) | GABRA1GABRB2GAANPSR1CA2 | |
| SCHEMBL26292596 | 0.79 | L3MBTL1 (0.47) | GABRA1GABRB2GAANPSR1ICMT | |
| SCHEMBL30041815 | 0.78 | CA2 (0.45) | GABRA1GABRB2GAANPSR1CA2 |
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-109678750-A | A kind of preparation method of N, N- diethyl -2- hydroxyl -2- phenyl acetamide | 上海天慈国际药业有限公司 | 2019-04-26 | — | — | CN | disclosed |