Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | WDR5 | P61964 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13170580 | 0.92 | APP (0.48) | APPFFAR1KCNH2MCHR1 | |
| SCHEMBL2131789 | 0.89 | ACHE (0.52) | ACHEKCNH2DRD2DRD4DRD3 | |
| SCHEMBL21715143 | 0.83 | APP (0.41) | APPFFAR1KCNH2MCHR1 | |
| SCHEMBL9510171 | 0.82 | ACACB (0.50) | APPDRD2DRD4DRD3L3MBTL1 | |
| SCHEMBL9512300 | 0.82 | NQO1 (0.43) | GRM5FFAR1KCNH2DRD2DRD4 | |
| SCHEMBL9508837 | 0.82 | APP (0.41) | APPGRM5FFAR1DRD2DRD4 | |
| SCHEMBL9509270 | 0.81 | CYP2A6 (0.44) | APPLMNAMCHR1 | |
| SCHEMBL13155582 | 0.80 | LTA4H (0.44) | ACHEKCNH2DRD2DRD4DRD3 | |
| SCHEMBL3589633 | 0.80 | NQO1 (0.50) | APPCA12CA1CA2CA9 | |
| SCHEMBL9511384 | 0.79 | ACACB (0.41) | APPGRM5KCNH2DRD2DRD4 |
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-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |