Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 3/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.31 |
| ▸ | AGXT | P21549 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7960670 | 0.76 | CES2 (0.40) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL28070466 | 0.75 | CES2 (0.42) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL14539581 | 0.72 | CES2 (0.47) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL28155953 | 0.72 | CES2 (0.47) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL10306200 | 0.72 | CES2 (0.47) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL28169688 | 0.72 | CES2 (0.40) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL6913446 | 0.72 | CES2 (0.47) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL8186328 | 0.72 | IDO1 (0.41) | CES2CES1IDO1TDO2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28334143 | 0.70 | IDO1 (0.44) | CES2CES1IDO1TDO2ALDH1A1 | |
| SCHEMBL11074082 | 0.70 | CES2 (0.39) | CES2CES1IDO1TDO2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3915981-A1 | METHOD FOR PREPARATION OF EFINACONAZOLE IN IONIC LIQUID MEDIUM | Daebong LS Co., Ltd. (KR) | 2021-12-01 | — | — | EP | disclosed |