Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20976657 | 0.84 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL13627869 | 0.79 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL5563954 | 0.78 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL21696131 | 0.78 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL13627870 | 0.75 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL8237341 | 0.75 | KDM4C (0.47) | ALDH1A1SMN1; SMN2L3MBTL1TSHRPOLB | |
| SCHEMBL11519344 | 0.75 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRPOLBMEN1 | |
| SCHEMBL9501632 | 0.73 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2HPGDNFKB1TSHR | |
| SCHEMBL423954 | 0.72 | — | — | |
| SCHEMBL29902944 | 0.72 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7619092-B2 | Piperidine compounds | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-11-17 | — | — | US | disclosed |
| US-7619092-B2 | Piperidine compounds | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-11-17 | — | — | US | disclosed |