Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 3/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | VHL | P40337 | 1/20 | 0.35 |
| ▸ | ELOC | Q15369 | 1/20 | 0.35 |
| ▸ | ELOB | Q15370 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL28618892 | 0.82 | CYP2C19 (0.42) | TSHRCYP2C19CYP2C9CYP1A2MAPK1 | |
| SCHEMBL15497439 | 0.82 | TSHR (0.48) | TSHRKIF11LTA4HCYP2C19CYP2C9 | |
| SCHEMBL3358894 | 0.81 | TSHR (0.56) | TSHRKIF11LTA4HCYP2C19CYP2C9 | |
| SCHEMBL27789330 | 0.79 | TSHR (0.59) | TSHRKIF11LTA4HCYP2C19CYP2C9 | |
| SCHEMBL8992820 | 0.75 | ESR1 (0.59) | TSHRKIF11LTA4HSMN1; SMN2KDM4E | |
| SCHEMBL17521308 | 0.75 | TSHR (0.54) | TSHRKIF11LTA4HCYP2C19CYP2C9 | |
| Benzyl Alcohol SCHEMBL29132362 | 0.75 | TSHR (0.61) | TSHRLTA4HCYP2C19CYP2C9CYP1A2 | |
| SCHEMBL7173455 | 0.75 | CYP1A2 (0.48) | TSHRCYP2C19CYP2C9CYP1A2MEN1 | |
| SCHEMBL36629 | 0.75 | CYP1A2 (0.48) | TSHRCYP2C19CYP2C9CYP1A2MEN1 | |
| Triphenylmethanol SCHEMBL28283279 | 0.74 | TSHR (0.67) | TSHRKIF11LTA4HCYP2C19CYP2C9 |
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-108530563-B | Application of α -diimine and its metal complex load in olefin polymerization | 天津工业大学 | 2020-06-19 | — | — | CN | disclosed |
| CN-108530567-B | α -diimine compound capable of forming double hydrogen bonds, metal complex containing compound, load and application of load | 天津工业大学 | 2020-02-07 | — | — | CN | disclosed |