Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7767016 | 0.76 | DGAT1 (0.38) | AAK1KDM1AKDM1B | |
| SCHEMBL7766222 | 0.72 | MAPT (0.33) | — | |
| SCHEMBL435716 | 0.69 | POLB (0.41) | AAK1KDM1AKCNH2KDM1B | |
| SCHEMBL30745361 | 0.69 | POLB (0.41) | AAK1KDM1AKCNH2KDM1B | |
| SCHEMBL1342628 | 0.68 | AKR1B1 (0.32) | AKR1B1KDM1AKDM1B | |
| SCHEMBL27678087 | 0.68 | PRKDC (0.34) | AKR1B1 | |
| SCHEMBL17877588 | 0.68 | MRGPRX4 (0.38) | — | |
| SCHEMBL505780 | 0.68 | KDM1A (0.48) | AKR1B1KDM1AKCNH2KDM1B | |
| SCHEMBL6734899 | 0.67 | POLB (0.40) | AAK1KDM1AKCNH2KDM1B | |
| SCHEMBL22206764 | 0.65 | EPHX2 (0.40) | AKR1B1AAK1KDM1AKCNH2KDM1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0727428-A1 | Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-08-21 | — | — | EP | disclosed |