Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 2/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22225396 | 1.00 | APP (0.67) | APPMAPTKCNH2CA12CA1 | |
| SCHEMBL19789990 | 0.88 | APP (0.47) | APPMAPTKCNH2CA12CA1 | |
| SCHEMBL2114741 | 0.85 | APP (0.92) | APPMAPTKCNH2CA12CA1 | |
| Diphenylacetylene SCHEMBL29188592 | 0.82 | APP (1.00) | APPMAPTKCNH2CA12CA1 | |
| SCHEMBL19790005 | 0.82 | APP (0.44) | APPMAPTKCNH2CA12CA1 | |
| Diphenylacetylene SCHEMBL960609 | 0.82 | APP (1.00) | APPMAPTKCNH2CA12CA1 | |
| Diphenylacetylene SCHEMBL68254 | 0.82 | APP (1.00) | APPMAPTKCNH2CA12CA1 | |
| SCHEMBL24390823 | 0.79 | APP (0.41) | APPMAPTKCNH2GRM5FFAR1 | |
| SCHEMBL19789996 | 0.79 | FFAR1 (0.49) | APPMAPTGRM5FFAR1CYP1A2 | |
| SCHEMBL19789973 | 0.79 | APP (0.41) | APPMAPTKCNH2GRM5FFAR1 |
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-2794816-B1 | LIQUID CRYSTAL MEDIUM AND HIGH FREQUENCY COMPONENTS COMPRISING SAME | MERCK PATENT GMBH (DE) | 2018-01-24 | — | — | EP | disclosed |