Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | ADK | P55263 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | F2RL1 | P55085 | 2/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | VCP | P55072 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL6002691 | 0.87 | NISCH (0.50) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL28067584 | 0.81 | GUSB (0.46) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL19782078 | 0.79 | NISCH (0.44) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL8540664 | 0.79 | TAAR1 (0.48) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL31627643 | 0.76 | NISCH (0.35) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL19769010 | 0.76 | TAAR1 (0.48) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL21883582 | 0.76 | NISCH (0.40) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL22096835 | 0.76 | TAAR1 (0.49) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL24088238 | 0.76 | NISCH (0.40) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL31429559 | 0.76 | SMPD3 (0.53) | NISCHMTORADKALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103562210-B | PI3K 110 δ are had to optionally benzo oxygen azepine * compound and using method | F. HOFFMANN-LA ROCHE AG (CH) | 2016-05-25 | — | — | CN | disclosed |