Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CTSD | P07339 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10461568 | 0.88 | SMN1; SMN2 (0.57) | SMN1; SMN2SCN9AHPGDALDH1A1LMNA | |
| SCHEMBL11551244 | 0.84 | KMT2A (0.50) | SMN1; SMN2SCN9AHPGDALDH1A1LMNA | |
| SCHEMBL31074983 | 0.82 | NPC1 (0.53) | SMN1; SMN2HPGDALDH1A1LMNAL3MBTL1 | |
| SCHEMBL341330 | 0.82 | NPC1 (0.53) | SMN1; SMN2HPGDALDH1A1LMNAL3MBTL1 | |
| SCHEMBL10459147 | 0.82 | SMN1; SMN2 (0.80) | SMN1; SMN2HPGDALDH1A1LMNAL3MBTL1 | |
| SCHEMBL4060124 | 0.81 | POLB (0.49) | SMN1; SMN2SCN9AHPGDALDH1A1LMNA | |
| SCHEMBL17530460 | 0.80 | LMNA (0.50) | ALDH1A1LMNAL3MBTL1MAPTTSHR | |
| SCHEMBL6775743 | 0.79 | SCN9A (0.57) | SCN9AL3MBTL1KMT2AMEN1NPC1 | |
| SCHEMBL7697374 | 0.79 | LMNA (0.56) | SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL28919413 | 0.78 | SMN1; SMN2 (0.58) | SMN1; SMN2SCN9AHPGDALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6251907-B1 | 1-(aryloxyalkyl)-4-(heteroaryl) piperazines and related compounds useful as antipsychotics and analgesics | AVENTIS PHARMACEUTICALS INC. | 2001-06-26 | — | — | US | disclosed |