Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.37 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL49367 | 0.96 | TSHR (0.38) | CES2CES1TSHRLTA4HPCSK9 | |
| SCHEMBL7944468 | 0.93 | TSHR (0.37) | CES2CES1TSHRLTA4HPCSK9 | |
| SCHEMBL9403468 | 0.93 | CYP3A4 (0.36) | CES2CES1TSHRLTA4HPCSK9 | |
| SCHEMBL7788089 | 0.93 | TSHR (0.37) | CES2CES1TSHRLTA4HPCSK9 | |
| SCHEMBL15658882 | 0.92 | CES2 (0.41) | CES2CES1SMN1; SMN2SIGMAR1 | |
| SCHEMBL301087 | 0.91 | CYP3A4 (0.41) | CES2CES1PCSK9CYP3A4TDP1 | |
| SCHEMBL6791527 | 0.89 | DNM1 (0.39) | CES2CES1LTA4HSMN1; SMN2SIGMAR1 | |
| SCHEMBL2550792 | 0.89 | LTA4H (0.38) | CES2CES1TSHRLTA4HPCSK9 | |
| SCHEMBL1241769 | 0.89 | CYP3A4 (0.39) | CES2CES1PCSK9CYP3A4TDP1 | |
| SCHEMBL7788033 | 0.88 | TSHR (0.34) | CES2CES1TSHRLTA4HPCSK9 |
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-118027253-A | Isobutenyl quaternary phosphonium salt ionic polymer, preparation method and application thereof, and antibacterial high polymer material | 中国石油化工股份有限公司 | 2024-05-14 | — | — | CN | disclosed |
| US-4187385-A | TITANIUM COMPONENT COPULVERIZED WITH ORGANOALUMINUM COMPOUND AND ETHYLENE OR A-OLEFINS, PARTICLE SIZE | MITSUI TOATSU CHEMICAL, INC. (JP) | 1980-02-05 | — | — | US | disclosed |