Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | THPO | P40225 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 3/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL563510 | 0.83 | APP (0.55) | APPNPC1RAB9AMTORKDM4E | |
| Bromide SCHEMBL28159616 | 0.81 | APP (0.52) | APPNPC1RAB9AMTORKDM4E | |
| SCHEMBL30495998 | 0.80 | APP (0.73) | APPNPC1RAB9AMTORKDM4E | |
| SCHEMBL403663 | 0.80 | APP (0.73) | APPNPC1RAB9AMTORKDM4E | |
| Benzene SCHEMBL28733255 | 0.80 | APP (0.73) | APPNPC1RAB9AMTORKDM4E | |
| SCHEMBL17312253 | 0.80 | APP (0.73) | APPNPC1RAB9AMTORKDM4E | |
| SCHEMBL9121457 | 0.77 | APP (0.69) | APPNPC1RAB9AMTORKDM4E | |
| SCHEMBL28151462 | 0.76 | APP (0.55) | APPNPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL15313378 | 0.75 | APP (0.58) | APPNPC1RAB9AMTORKDM4E | |
| Fluorobenzene SCHEMBL28040305 | 0.74 | APP (0.44) | APPNPC1RAB9AMTORKDM4E |
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 | claimed |