Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.30 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL20772092 | 0.93 | CYP4F2 (0.33) | CYP4F2CYP4A11DGAT1EIF2AK4CTSK | |
| SCHEMBL10004931 | 0.89 | MAPK1 (0.35) | CYP4F2CYP4A11DGAT1 | |
| SCHEMBL6355124 | 0.80 | NPSR1 (0.33) | NPSR1CYP4F2CYP4A11HPGDDGAT1 | |
| SCHEMBL22098152 | 0.79 | USP2 (0.43) | CYP4F2CYP4A11 | |
| SCHEMBL28487708 | 0.79 | KDM4E (0.33) | CYP4F2CYP4A11KDM4E | |
| SCHEMBL15114643 | 0.79 | NPSR1 (0.34) | NPSR1CYP4F2CYP4A11HPGD | |
| SCHEMBL21564990 | 0.78 | FFAR3 (0.37) | NPSR1CYP4F2CYP4A11HPGDDGAT1 | |
| SCHEMBL15867797 | 0.78 | CHRM2 (0.40) | CYP4F2CYP4A11 | |
| SCHEMBL15867801 | 0.78 | CHRM2 (0.40) | CYP4F2CYP4A11 | |
| Hydrochloric Acid SCHEMBL6643227 | 0.78 | KDM4E (0.32) | CYP4F2CYP4A11KDM4E |
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-109824516-A | A kind of preparation method of trans- -4- hydroxyl thiacyclohexane t-butyl formate | 泰州精英化成医药科技有限公司 | 2019-05-31 | — | — | CN | disclosed |