Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MPO | P05164 | 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 | |
|---|---|---|---|---|
| SCHEMBL673162 | 0.91 | APP (0.55) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL714294 | 0.89 | APP (0.59) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL352378 | 0.87 | HDAC8 (0.42) | CA12CA1CA2CA9CA14 | |
| SCHEMBL709673 | 0.85 | APP (0.63) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL187127 | 0.82 | CA1 (0.58) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL15441139 | 0.81 | APP (0.46) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL10033154 | 0.81 | APP (0.46) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL30998827 | 0.80 | CA1 (0.55) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL30998834 | 0.80 | CA1 (0.55) | APPKCNH2CA12CA1CA2 | |
| SCHEMBL31403396 | 0.80 | CA1 (0.55) | APPKCNH2CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001012576-A1 | SYNTHESIS OF CYCLOOCTATETRAENE DERIVATIVES AND THEIR USE AS ELECTRON TRANSPORTERS IN ORGANIC LIGHT EMITTING DIODES | THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2001-02-22 | — | — | WO | disclosed |