Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 8/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15738287 | 0.87 | SMN1; SMN2 (0.54) | EPHX2CYP2C9CYP2C19HCAR2HDAC3 | |
| SCHEMBL27790062 | 0.79 | EPHX2 (0.65) | EPHX2CYP2C9CYP2C19HDAC3HDAC1 | |
| SCHEMBL10245905 | 0.76 | NAAA (0.60) | HCAR2HDAC3HDAC1SMN1; SMN2RAB9A | |
| SCHEMBL27634018 | 0.75 | KDM4E (0.54) | EPHX2CYP2C19HDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL13101050 | 0.75 | PREP (0.45) | HCAR2HDAC3HDAC1NPC1TSHR | |
| SCHEMBL22322564 | 0.74 | HCAR2 (0.52) | HCAR2SMN1; SMN2PIK3CDLMNAMEN1 | |
| SCHEMBL31087408 | 0.74 | RAB9A (0.70) | EPHX2HDAC3HDAC1SMN1; SMN2RAB9A | |
| SCHEMBL13113096 | 0.72 | HCAR2 (0.48) | HCAR2HDAC3HDAC1SMN1; SMN2NPC1 | |
| SCHEMBL7875218 | 0.71 | SMN1; SMN2 (0.43) | EPHX2CYP2C9CYP2C19SMN1; SMN2RAB9A | |
| SCHEMBL21431437 | 0.71 | CA12 (0.50) | HCAR2HDAC3HDAC1LMNAMEN1 |
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-2010136474-A2 | SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS | NOVARTIS AG (CH) | 2010-12-02 | — | — | WO | disclosed |