Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 8/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 8/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 8/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 8/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 8/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 8/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.36 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4592497 | 0.79 | NR2E1 (0.39) | NR2E1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL27962043 | 0.76 | CYP2E1 (0.38) | NR2E1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22184931 | 0.74 | HCAR1 (0.48) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL2824263 | 0.72 | PSEN1 (0.44) | NR2E1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL2824693 | 0.69 | KDM4E (0.50) | NR2E1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL29209813 | 0.68 | MPL (0.42) | BCAT2BCAT1 | |
| SCHEMBL22184923 | 0.68 | KCNH2 (0.48) | NR2E1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL103547 | 0.68 | GAA (0.46) | PTGESMAOA | |
| SCHEMBL18243415 | 0.67 | SCN9A (0.41) | SCN9A | |
| SCHEMBL22199042 | 0.67 | NR2E1 (0.45) | NR2E1PSEN1PSEN2APH1BNCSTN |
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-1828194-B1 | TETRACYCLIC IMIDAZO-BENZODIAZEPINES AS GABA RECEPTORS MODULATORS | HOFFMANN LA ROCHE (CH) | 2008-05-28 | — | — | EP | disclosed |