Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | DDO | Q99489 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | PYGL | P06737 | 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 | |
|---|---|---|---|---|
| SCHEMBL21047739 | 1.00 | AHR (0.44) | AHRSMYD3CA12CA1CA3 | |
| SCHEMBL8792860 | 0.87 | FLT3 (0.43) | AHRSMYD3HRH4FLT3CYP2A6 | |
| SCHEMBL27787928 | 0.84 | KDM4C (0.46) | AHRKDM4CKDM4EMAPT | |
| SCHEMBL651959 | 0.83 | KDM4C (0.49) | KDM4CKDM4EALDH1A1MAPT | |
| SCHEMBL21047903 | 0.72 | KCNN3 (0.53) | — | |
| SCHEMBL6583703 | 0.71 | AOC3 (0.40) | CA12CA1CA3CA4CA6 | |
| SCHEMBL21047871 | 0.71 | CA12 (0.41) | SMYD3CA12CA1CA3CA4 | |
| SCHEMBL29586664 | 0.71 | CA12 (0.41) | SMYD3CA12CA1CA3CA4 | |
| SCHEMBL21047656 | 0.70 | KDM4E (0.38) | PIM1KDM4EALDH1A1MAPT | |
| SCHEMBL21047649 | 0.70 | CA12 (0.40) | SMYD3CA12CA1CA3CA4 |
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-109563016-B | Method for producing perfluoroalkyl compound using monohydroperfluoroalkane as starting material | 关东电化工业株式会社 | 2022-05-13 | — | — | CN | disclosed |