Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 2/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27963434 | 0.79 | BTK (0.38) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL16654374 | 0.79 | BTK (0.38) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL17017335 | 0.79 | BTK (0.38) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL3052729 | 0.77 | BTK (0.46) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL17007379 | 0.77 | BTK (0.46) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL3378203 | 0.75 | BTK (0.35) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL17007311 | 0.75 | BTK (0.35) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL18607626 | 0.72 | BTK (0.33) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL13053327 | 0.72 | KMT2A (0.39) | BTKGAAMEN1MAPK1KMT2A | |
| SCHEMBL15827486 | 0.72 | KMT2A (0.39) | BTKGAAMEN1MAPK1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106164047-B | 1,2- substituted cyclopentane as orexin receptor antagonists | 武田药品工业株式会社 | 2019-04-16 | — | — | CN | disclosed |
| CN-106164047-A | 1,2 substituted cyclopentanes as orexin receptor antagonists | 武田药品工业株式会社 | 2016-11-23 | — | — | CN | disclosed |