Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.49 |
| ▸ | CA1 | P00915 | 7/20 | 0.49 |
| ▸ | CA9 | Q16790 | 7/20 | 0.49 |
| ▸ | CA12 | O43570 | 6/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.49 |
| ▸ | CA5A | P35218 | 4/20 | 0.49 |
| ▸ | CA7 | P43166 | 4/20 | 0.49 |
| ▸ | CA3 | P07451 | 3/20 | 0.49 |
| ▸ | CA4 | P22748 | 3/20 | 0.49 |
| ▸ | CA6 | P23280 | 3/20 | 0.49 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | ALPI | P09923 | 1/20 | 0.43 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.41 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL929164 | 0.82 | ALPL (0.53) | CA2CA1CA9CA12CA14 | |
| SCHEMBL18263184 | 0.78 | ALDH1A1 (0.51) | CA2CA1CA9CA12CA5A | |
| SCHEMBL29052062 | 0.78 | PAX8 (0.44) | ALDH1A1GPR17HTTKMT2AGAA | |
| SCHEMBL15022229 | 0.77 | CA1 (0.47) | CA2CA1CA9CA12CA14 | |
| SCHEMBL1500136 | 0.75 | ALDH1A1 (0.43) | CA2CA1CA9CA12CA14 | |
| SCHEMBL28216404 | 0.75 | ALDH1A1 (0.39) | CA2CA1CA9CA12CA14 | |
| SCHEMBL28216405 | 0.75 | ALDH1A1 (0.39) | CA2CA1CA9CA12CA14 | |
| SCHEMBL11041999 | 0.75 | HTT (0.59) | CA2CA1CA9CA12CA14 | |
| SCHEMBL927603 | 0.74 | ALDH1A1 (0.57) | CA2CA1CA9CA12CA14 | |
| SCHEMBL14594621 | 0.73 | HTT (0.62) | CA2CA1CA9CA12CA14 |
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-107108416-B | Preparation method of 1, 2-dicyclopropylethylphenol and optical isomer thereof | 四川海思科制药有限公司 | 2019-12-20 | — | — | CN | disclosed |
| CN-107108416-A | A kind of preparation method of 1,2 Bicyclopropyl ethyl -phenol and its optical isomer | 四川海思科制药有限公司 | 2017-08-29 | — | — | CN | disclosed |
| WO-2016188490-A1 | METHOD FOR PREPARING 1,2-DICYCLOPROPYLETHYLPHENOL AND OPTICAL ISOMER THEREOF | 四川海思科制药有限公司 | 2016-12-01 | — | — | WO | disclosed |
| WO-2016188490-A1 | METHOD FOR PREPARING 1,2-DICYCLOPROPYLETHYLPHENOL AND OPTICAL ISOMER THEREOF | 四川海思科制药有限公司 | 2016-12-01 | — | — | WO | disclosed |