Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL18458489 | 0.87 | MAOB (0.37) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL18458493 | 0.85 | KIF11 (0.41) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL18458495 | 0.85 | KIF11 (0.41) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL18458496 | 0.83 | SLC6A4 (0.38) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL18458747 | 0.83 | AKR1C3 (0.41) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL18458826 | 0.83 | AKR1C3 (0.41) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL20209757 | 0.82 | RARB (0.37) | APPCYP3A4CYP2C9CYP2C19CA12 | |
| SCHEMBL18458698 | 0.81 | KIF11 (0.39) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL20209756 | 0.80 | RARB (0.38) | APPCYP3A4CYP2C9CYP2C19SLC6A4 | |
| SCHEMBL20160764 | 0.80 | KIF11 (0.43) | APPCYP3A4CYP2C9CYP2C19SLC6A4 |
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-3173457-A1 | LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY ELEMENT OBTAINED USING SAME | DIC Corporation (JP) | 2017-05-31 | — | — | EP | disclosed |