Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 2/20 | 0.32 |
| ▸ | ADH1C | P00326 | 2/20 | 0.32 |
| ▸ | ADH1A | P07327 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Cyclopropane SCHEMBL11789277 | 1.00 | — | — | |
| Cyclopentane SCHEMBL11787886 | 1.00 | ADH1B (0.32) | ADH1BADH1CADH1A | |
| Cyclooctane SCHEMBL11798106 | 1.00 | ADH1B (0.32) | ADH1BADH1CADH1A | |
| SCHEMBL9293 | 0.90 | — | — | |
| SCHEMBL30154499 | 0.90 | TDP1 (0.30) | ADH1BADH1CADH1A | |
| SCHEMBL14637528 | 0.87 | — | — | |
| SCHEMBL29119755 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL28600190 | 0.87 | — | — | |
| Cyclohexene SCHEMBL28485335 | 0.82 | — | — | |
| Isopropyl Alcohol SCHEMBL2441841 | 0.81 | ALDH1A1 (0.38) | — |
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-108623446-A | A kind of method of synthesis 3,3- difluoro cyclobutane formates | 北京艾德旺科技发展有限公司 | 2018-10-09 | — | — | CN | claimed |
| CN-105916855-B | Substituted 4, 5, 6, 7-tetrahydropyrazolo [1,5-a ] pyrazine derivatives as casein kinase 1D/E inhibitors | 百时美施贵宝公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-108623446-A | A kind of method of synthesis 3,3- difluoro cyclobutane formates | 北京艾德旺科技发展有限公司 | 2018-10-09 | — | — | CN | disclosed |