Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | GNRHR | P30968 | 3/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5561606 | 0.89 | NPC1 (0.36) | RAB9ANPC1PDE7AALDH1A1MEN1 | |
| SCHEMBL6027038 | 0.89 | GNRHR (0.39) | GNRHRALDH1A1MEN1LMNAMAPT | |
| SCHEMBL5561059 | 0.87 | KCNA5 (0.46) | GNRHRNFKB1NFKB2RELAALDH1A1 | |
| SCHEMBL5563683 | 0.86 | PTGER3 (0.42) | RORCALDH1A1MEN1MAPTMAPK1 | |
| SCHEMBL5556632 | 0.86 | MAPT (0.40) | RAB9ANPC1NFKB1NFKB2RELA | |
| SCHEMBL5563041 | 0.86 | GAA (0.39) | RAB9ANPC1NFKB1NFKB2RELA | |
| SCHEMBL5560963 | 0.85 | F2 (0.48) | RAB9ANPC1GNRHRALDH1A1MEN1 | |
| SCHEMBL5561610 | 0.85 | ALDH1A1 (0.37) | RAB9ANPC1PDE7AALDH1A1MEN1 | |
| SCHEMBL5561387 | 0.85 | GAA (0.40) | RAB9ANPC1NFKB1NFKB2RELA | |
| SCHEMBL5562092 | 0.84 | LMNA (0.34) | RAB9ANPC1PDE7AALDH1A1MEN1 |
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-1631296-B1 | 2,3,4,5-TETRAHYDROBENZO¬F|¬1,4|OXAZEPINE-5-CARBOXYLIC ACID AMIDE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | HOFFMANN LA ROCHE (CH) | 2007-04-25 | — | — | EP | disclosed |