Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.50 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30786693 | 0.89 | CES2 (0.61) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL1994068 | 0.89 | CES2 (0.61) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL2694877 | 0.86 | TAS1R3 (0.53) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL17682226 | 0.85 | PDK1 (0.48) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL23253962 | 0.84 | KMT2A (0.47) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL1787779 | 0.83 | ACHE (0.57) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL27425778 | 0.82 | MAPT (0.55) | CYP4F2CYP4A11CA2CES2ALDH1A1 | |
| SCHEMBL29427226 | 0.82 | CYP4F2 (0.63) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL5593479 | 0.81 | CYP4F2 (0.52) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL19601357 | 0.81 | CYP4F2 (0.52) | CYP4F2CYP4A11CA12CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104803826-B | A kind of method utilizing hexafluoropropene that aryl boric acid directly aoxidizes seven fluorine isopropylations | 中国科学院上海有机化学研究所 | 2016-08-17 | — | — | CN | disclosed |
| CN-104803826-A | Method for directly oxidizing arylboronic acid into heptafluoroisopropyl by utilizing hexafluoropropylene | SHANGHAI INST ORGANIC CHEM | 2015-07-29 | — | — | CN | disclosed |